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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=NC=C1)C(=O)CN2C3=C(C=CC(=C3)C(=O)O)C(=C2C4=COC=C4)C5CCCCC5

Isomeric SMILES

CCN(CC1=CC=NC=C1)C(=O)CN2C3=C(C=CC(=C3)C(=O)O)C(=C2C4=COC=C4)C5CCCCC5

InChI

InChI=1S/C29H31N3O4/c1-2-31(17-20-10-13-30-14-11-20)26(33)18-32-25-16-22(29(34)35)8-9-24(25)27(21-6-4-3-5-7-21)28(32)23-12-15-36-19-23/h8-16,19,21H,2-7,17-18H2,1H3,(H,34,35)