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

Systemtic Name: 3-cyclohexyl-2-(furan-3-yl)-1-[2-[methyl(propyl)amino]-2-oxidanylidene-ethyl]indole-6-carboxylic acid Openeye Name: 3-cyclohexyl-2-(3-furyl)-1-[2-[methyl(propyl)amino]-2-oxo-ethyl]indole-6-carboxylic acid CAS Name: 3-cyclohexyl-2-(3-furanyl)-1-[2-[methyl(propyl)amino]-2-oxoethyl]-6-indolecarboxylic acid IUPAC Name: 3-cyclohexyl-2-(furan-3-yl)-1-[2-[methyl(propyl)amino]-2-oxoethyl]indole-6-carboxylic acid Traditional Name: 3-cyclohexyl-2-(3-furyl)-1-[2-keto-2-[methyl(propyl)amino]ethyl]indole-6-carboxylic acid Formula: C25H30N2O4 MolecularWeight: 422.5167

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C)C(=O)CN1C2=C(C=CC(=C2)C(=O)O)C(=C1C3=COC=C3)C4CCCCC4

Isomeric SMILES

CCCN(C)C(=O)CN1C2=C(C=CC(=C2)C(=O)O)C(=C1C3=COC=C3)C4CCCCC4

InChI

InChI=1S/C25H30N2O4/c1-3-12-26(2)22(28)15-27-21-14-18(25(29)30)9-10-20(21)23(17-7-5-4-6-8-17)24(27)19-11-13-31-16-19/h9-11,13-14,16-17H,3-8,12,15H2,1-2H3,(H,29,30)