[2-[[3-(diethylamino)-2-oxidanyl-propyl]carbamoyl]-1-phenyl-indol-3-yl] 3,4-dimethoxybenzoate

Systemtic Name: [2-[[3-(diethylamino)-2-oxidanyl-propyl]carbamoyl]-1-phenyl-indol-3-yl] 3,4-dimethoxybenzoate Openeye Name: [2-[[3-(diethylamino)-2-hydroxy-propyl]carbamoyl]-1-phenyl-indol-3-yl] 3,4-dimethoxybenzoate CAS Name: 3,4-dimethoxybenzoic acid [2-[[[3-(diethylamino)-2-hydroxypropyl]amino]-oxomethyl]-1-phenyl-3-indolyl] ester IUPAC Name: [2-[[3-(diethylamino)-2-hydroxypropyl]carbamoyl]-1-phenylindol-3-yl] 3,4-dimethoxybenzoate Traditional Name: 3,4-dimethoxybenzoic acid [2-[[3-(diethylamino)-2-hydroxy-propyl]carbamoyl]-1-phenyl-indol-3-yl] ester Formula: C31H35N3O6 MolecularWeight: 545.6261

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC(CNC(=O)C1=C(C2=CC=CC=C2N1C3=CC=CC=C3)OC(=O)C4=CC(=C(C=C4)OC)OC)O

Isomeric SMILES

CCN(CC)CC(CNC(=O)C1=C(C2=CC=CC=C2N1C3=CC=CC=C3)OC(=O)C4=CC(=C(C=C4)OC)OC)O

InChI

InChI=1S/C31H35N3O6/c1-5-33(6-2)20-23(35)19-32-30(36)28-29(40-31(37)21-16-17-26(38-3)27(18-21)39-4)24-14-10-11-15-25(24)34(28)22-12-8-7-9-13-22/h7-18,23,35H,5-6,19-20H2,1-4H3,(H,32,36)