methyl 3-[4-oxidanylidene-4-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)butanoyl]-1H-indole-5-carboxylate

Systemtic Name: methyl 3-[4-oxidanylidene-4-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)butanoyl]-1H-indole-5-carboxylate Openeye Name: methyl 3-[4-oxo-4-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)butanoyl]-1H-indole-5-carboxylate CAS Name: 3-[1,4-dioxo-4-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)butyl]-1H-indole-5-carboxylic acid methyl ester IUPAC Name: methyl 3-[4-oxo-4-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)butanoyl]-1H-indole-5-carboxylate Traditional Name: 3-[4-keto-4-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)butanoyl]-1H-indole-5-carboxylic acid methyl ester Formula: C25H24N2O4 MolecularWeight: 416.46906

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)NC=C2C(=O)CCC(=O)C3CC(=CCN3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)NC=C2C(=O)CCC(=O)C3CC(=CCN3)C4=CC=CC=C4

InChI

InChI=1S/C25H24N2O4/c1-31-25(30)18-7-8-21-19(13-18)20(15-27-21)23(28)9-10-24(29)22-14-17(11-12-26-22)16-5-3-2-4-6-16/h2-8,11,13,15,22,26-27H,9-10,12,14H2,1H3