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

Systemtic Name: 4-(cyclopentylmethylcarbamoyl)-3-methoxy-2-[[3-(3-methoxy-3-oxidanylidene-propyl)indol-1-yl]methyl]benzoic acid Openeye Name: 4-(cyclopentylmethylcarbamoyl)-3-methoxy-2-[[3-(3-methoxy-3-oxo-propyl)indol-1-yl]methyl]benzoic acid CAS Name: 4-[(cyclopentylmethylamino)-oxomethyl]-3-methoxy-2-[[3-(3-methoxy-3-oxopropyl)-1-indolyl]methyl]benzoic acid IUPAC Name: 4-(cyclopentylmethylcarbamoyl)-3-methoxy-2-[[3-(3-methoxy-3-oxopropyl)indol-1-yl]methyl]benzoic acid Traditional Name: 4-(cyclopentylmethylcarbamoyl)-2-[[3-(3-keto-3-methoxy-propyl)indol-1-yl]methyl]-3-methoxy-benzoic acid Formula: C28H32N2O6 MolecularWeight: 492.56348

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1CN2C=C(C3=CC=CC=C32)CCC(=O)OC)C(=O)O)C(=O)NCC4CCCC4

Isomeric SMILES

COC1=C(C=CC(=C1CN2C=C(C3=CC=CC=C32)CCC(=O)OC)C(=O)O)C(=O)NCC4CCCC4

InChI

InChI=1S/C28H32N2O6/c1-35-25(31)14-11-19-16-30(24-10-6-5-9-20(19)24)17-23-21(28(33)34)12-13-22(26(23)36-2)27(32)29-15-18-7-3-4-8-18/h5-6,9-10,12-13,16,18H,3-4,7-8,11,14-15,17H2,1-2H3,(H,29,32)(H,33,34)