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

Systemtic Name: 4-[[6-[2-(dipropylamino)-2-oxidanylidene-ethyl]indol-1-yl]methyl]-3-methoxy-benzoic acid Openeye Name: 4-[[6-[2-(dipropylamino)-2-oxo-ethyl]indol-1-yl]methyl]-3-methoxy-benzoic acid CAS Name: 4-[[6-[2-(dipropylamino)-2-oxoethyl]-1-indolyl]methyl]-3-methoxybenzoic acid IUPAC Name: 4-[[6-[2-(dipropylamino)-2-oxoethyl]indol-1-yl]methyl]-3-methoxybenzoic acid Traditional Name: 4-[[6-[2-(dipropylamino)-2-keto-ethyl]indol-1-yl]methyl]-3-methoxy-benzoic acid Formula: C25H30N2O4 MolecularWeight: 422.5167

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C(=O)CC1=CC2=C(C=C1)C=CN2CC3=C(C=C(C=C3)C(=O)O)OC

Isomeric SMILES

CCCN(CCC)C(=O)CC1=CC2=C(C=C1)C=CN2CC3=C(C=C(C=C3)C(=O)O)OC

InChI

InChI=1S/C25H30N2O4/c1-4-11-26(12-5-2)24(28)15-18-6-7-19-10-13-27(22(19)14-18)17-21-9-8-20(25(29)30)16-23(21)31-3/h6-10,13-14,16H,4-5,11-12,15,17H2,1-3H3,(H,29,30)