3-methoxy-4-[1-[5-[(1-methyl-2-oxidanylidene-pyrrolidin-3-yl)methyl]-1H-indol-3-yl]butyl]benzoic acid

Systemtic Name: 3-methoxy-4-[1-[5-[(1-methyl-2-oxidanylidene-pyrrolidin-3-yl)methyl]-1H-indol-3-yl]butyl]benzoic acid Openeye Name: 3-methoxy-4-[1-[5-[(1-methyl-2-oxo-pyrrolidin-3-yl)methyl]-1H-indol-3-yl]butyl]benzoic acid CAS Name: 3-methoxy-4-[1-[5-[(1-methyl-2-oxo-3-pyrrolidinyl)methyl]-1H-indol-3-yl]butyl]benzoic acid IUPAC Name: 3-methoxy-4-[1-[5-[(1-methyl-2-oxopyrrolidin-3-yl)methyl]-1H-indol-3-yl]butyl]benzoic acid Traditional Name: 4-[1-[5-[(2-keto-1-methyl-pyrrolidin-3-yl)methyl]-1H-indol-3-yl]butyl]-3-methoxy-benzoic acid Formula: C26H30N2O4 MolecularWeight: 434.5274

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=C(C=C(C=C1)C(=O)O)OC)C2=CNC3=C2C=C(C=C3)CC4CCN(C4=O)C

Isomeric SMILES

CCCC(C1=C(C=C(C=C1)C(=O)O)OC)C2=CNC3=C2C=C(C=C3)CC4CCN(C4=O)C

InChI

InChI=1S/C26H30N2O4/c1-4-5-19(20-8-7-18(26(30)31)14-24(20)32-3)22-15-27-23-9-6-16(13-21(22)23)12-17-10-11-28(2)25(17)29/h6-9,13-15,17,19,27H,4-5,10-12H2,1-3H3,(H,30,31)