2,5-dioxopyrrolidin-1-yl 1-[(3-{2-azatricyclo[10.4.0.0?,?]hexadeca-1(16),4,6,8,12,14-hexaen-10-yn-2-yl}-3-oxopropyl)carbamoyl]-3,6,9,12-tetraoxapentadecan-15-oate

CAS: 2100306-58-7

Formula: C34H39N3O10

SMILES: O=C(CCOCCOCCOCCOCCC(=O)ON1C(=O)CCC1=O)NCCC(=O)N1CC2=CC=CC=C2C#CC2=CC=CC=C12

IUPAC: 2,5-dioxopyrrolidin-1-yl 1-[(3-{2-azatricyclo[10.4.0.0?,?]hexadeca-1(16),4,6,8,12,14-hexaen-10-yn-2-yl}-3-oxopropyl)carbamoyl]-3,6,9,12-tetraoxapentadecan-15-oate

InChI: InChI=1S/C34H39N3O10/c38-30(35-16-13-31(39)36-25-28-7-2-1-5-26(28)9-10-27-6-3-4-8-29(27)36)14-17-43-19-21-45-23-24-46-22-20-44-18-15-34(42)47-37-32(40)11-12-33(37)41/h1-8H,11-25H2,(H,35,38)

Composition: C (62.86%), H (6.05%), N (6.47%), O (24.63%)

Molar Mass: 649.697

Atom Count: 86

Heavy Atom Count: 47