6-[[4-[1-(4-chlorophenyl)carbonyl-5-methoxy-2-methyl-indol-3-yl]-3-oxidanylidene-butanoyl]amino]hexanoic acid

Systemtic Name: 6-[[4-[1-(4-chlorophenyl)carbonyl-5-methoxy-2-methyl-indol-3-yl]-3-oxidanylidene-butanoyl]amino]hexanoic acid Openeye Name: 6-[[4-[1-(4-chlorobenzoyl)-5-methoxy-2-methyl-indol-3-yl]-3-oxo-butanoyl]amino]hexanoic acid CAS Name: 6-[[4-[1-[(4-chlorophenyl)-oxomethyl]-5-methoxy-2-methyl-3-indolyl]-1,3-dioxobutyl]amino]hexanoic acid IUPAC Name: 6-[[4-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]-3-oxobutanoyl]amino]hexanoic acid Traditional Name: 6-[[4-[1-(4-chlorobenzoyl)-5-methoxy-2-methyl-indol-3-yl]-3-keto-butanoyl]amino]hexanoic acid Formula: C27H29ClN2O6 MolecularWeight: 512.98196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1C(=O)C3=CC=C(C=C3)Cl)C=CC(=C2)OC)CC(=O)CC(=O)NCCCCCC(=O)O

Isomeric SMILES

CC1=C(C2=C(N1C(=O)C3=CC=C(C=C3)Cl)C=CC(=C2)OC)CC(=O)CC(=O)NCCCCCC(=O)O

InChI

InChI=1S/C27H29ClN2O6/c1-17-22(14-20(31)15-25(32)29-13-5-3-4-6-26(33)34)23-16-21(36-2)11-12-24(23)30(17)27(35)18-7-9-19(28)10-8-18/h7-12,16H,3-6,13-15H2,1-2H3,(H,29,32)(H,33,34)