4-[6-[2-(cyclopentylmethylamino)-2-oxidanylidene-ethyl]indol-1-yl]-3-methoxy-2-methyl-benzoic acid

Systemtic Name: 4-[6-[2-(cyclopentylmethylamino)-2-oxidanylidene-ethyl]indol-1-yl]-3-methoxy-2-methyl-benzoic acid Openeye Name: 4-[6-[2-(cyclopentylmethylamino)-2-oxo-ethyl]indol-1-yl]-3-methoxy-2-methyl-benzoic acid CAS Name: 4-[6-[2-(cyclopentylmethylamino)-2-oxoethyl]-1-indolyl]-3-methoxy-2-methylbenzoic acid IUPAC Name: 4-[6-[2-(cyclopentylmethylamino)-2-oxoethyl]indol-1-yl]-3-methoxy-2-methylbenzoic acid Traditional Name: 4-[6-[2-(cyclopentylmethylamino)-2-keto-ethyl]indol-1-yl]-3-methoxy-2-methyl-benzoic acid Formula: C25H28N2O4 MolecularWeight: 420.50082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1OC)N2C=CC3=C2C=C(C=C3)CC(=O)NCC4CCCC4)C(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1OC)N2C=CC3=C2C=C(C=C3)CC(=O)NCC4CCCC4)C(=O)O

InChI

InChI=1S/C25H28N2O4/c1-16-20(25(29)30)9-10-21(24(16)31-2)27-12-11-19-8-7-18(13-22(19)27)14-23(28)26-15-17-5-3-4-6-17/h7-13,17H,3-6,14-15H2,1-2H3,(H,26,28)(H,29,30)