4-[(2S,4S)-4-ethoxy-1-[(5-methoxy-7-methyl-1H-indol-4-yl)methyl]piperidin-2-yl]benzoic acid

CAS: 1644670-37-0

Formula: C25H30N2O4

SMILES: CCO[C@H]1CCN(CC2=C3C=CNC3=C(C)C=C2OC)[C@@H](C1)C1=CC=C(C=C1)C(O)=O

IUPAC: 4-[(2S,4S)-4-ethoxy-1-[(5-methoxy-7-methyl-1H-indol-4-yl)methyl]piperidin-2-yl]benzoic acid

InChI: InChI=1S/C25H30N2O4/c1-4-31-19-10-12-27(22(14-19)17-5-7-18(8-6-17)25(28)29)15-21-20-9-11-26-24(20)16(2)13-23(21)30-3/h5-9,11,13,19,22,26H,4,10,12,14-15H2,1-3H3,(H,28,29)/t19-,22-/m0/s1

Composition: C (71.07%), H (7.16%), N (6.63%), O (15.15%)

Molar Mass: 422.525

Atom Count: 61

Heavy Atom Count: 31