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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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