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

Systemtic Name: 3-methoxy-4-[[5-[(2-oxidanylidene-1-propyl-pyrrolidin-3-yl)methyl]-1-propyl-indol-3-yl]methyl]benzoic acid Openeye Name: 3-methoxy-4-[[5-[(2-oxo-1-propyl-pyrrolidin-3-yl)methyl]-1-propyl-indol-3-yl]methyl]benzoic acid CAS Name: 3-methoxy-4-[[5-[(2-oxo-1-propyl-3-pyrrolidinyl)methyl]-1-propyl-3-indolyl]methyl]benzoic acid IUPAC Name: 3-methoxy-4-[[5-[(2-oxo-1-propylpyrrolidin-3-yl)methyl]-1-propylindol-3-yl]methyl]benzoic acid Traditional Name: 4-[[5-[(2-keto-1-propyl-pyrrolidin-3-yl)methyl]-1-propyl-indol-3-yl]methyl]-3-methoxy-benzoic acid Formula: C28H34N2O4 MolecularWeight: 462.58056

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCC(C1=O)CC2=CC3=C(C=C2)N(C=C3CC4=C(C=C(C=C4)C(=O)O)OC)CCC

Isomeric SMILES

CCCN1CCC(C1=O)CC2=CC3=C(C=C2)N(C=C3CC4=C(C=C(C=C4)C(=O)O)OC)CCC

InChI

InChI=1S/C28H34N2O4/c1-4-11-29-13-10-21(27(29)31)14-19-6-9-25-24(15-19)23(18-30(25)12-5-2)16-20-7-8-22(28(32)33)17-26(20)34-3/h6-9,15,17-18,21H,4-5,10-14,16H2,1-3H3,(H,32,33)