3-cyclohexyl-2-(furan-3-yl)-1-[2-[methyl(2-pyridin-4-ylethyl)amino]-2-oxidanylidene-ethyl]indole-6-carboxylic acid

Systemtic Name: 3-cyclohexyl-2-(furan-3-yl)-1-[2-[methyl(2-pyridin-4-ylethyl)amino]-2-oxidanylidene-ethyl]indole-6-carboxylic acid Openeye Name: 3-cyclohexyl-2-(3-furyl)-1-[2-[methyl-[2-(4-pyridyl)ethyl]amino]-2-oxo-ethyl]indole-6-carboxylic acid CAS Name: 3-cyclohexyl-2-(3-furanyl)-1-[2-[methyl(2-pyridin-4-ylethyl)amino]-2-oxoethyl]-6-indolecarboxylic acid IUPAC Name: 3-cyclohexyl-2-(furan-3-yl)-1-[2-[methyl(2-pyridin-4-ylethyl)amino]-2-oxoethyl]indole-6-carboxylic acid Traditional Name: 3-cyclohexyl-2-(3-furyl)-1-[2-keto-2-[methyl-[2-(4-pyridyl)ethyl]amino]ethyl]indole-6-carboxylic acid Formula: C29H31N3O4 MolecularWeight: 485.57414

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=NC=C1)C(=O)CN2C3=C(C=CC(=C3)C(=O)O)C(=C2C4=COC=C4)C5CCCCC5

Isomeric SMILES

CN(CCC1=CC=NC=C1)C(=O)CN2C3=C(C=CC(=C3)C(=O)O)C(=C2C4=COC=C4)C5CCCCC5

InChI

InChI=1S/C29H31N3O4/c1-31(15-11-20-9-13-30-14-10-20)26(33)18-32-25-17-22(29(34)35)7-8-24(25)27(21-5-3-2-4-6-21)28(32)23-12-16-36-19-23/h7-10,12-14,16-17,19,21H,2-6,11,15,18H2,1H3,(H,34,35)