ethyl 1-[2-[1-(1-methylindol-3-yl)-3-oxidanylidene-1H-isoindol-2-yl]propanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-[1-(1-methylindol-3-yl)-3-oxidanylidene-1H-isoindol-2-yl]propanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-[1-(1-methylindol-3-yl)-3-oxo-isoindolin-2-yl]propanoyl]piperidine-4-carboxylate CAS Name: 1-[2-[1-(1-methyl-3-indolyl)-3-oxo-1H-isoindol-2-yl]-1-oxopropyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[1-(1-methylindol-3-yl)-3-oxo-1H-isoindol-2-yl]propanoyl]piperidine-4-carboxylate Traditional Name: 1-[2-[1-keto-3-(1-methylindol-3-yl)isoindolin-2-yl]propanoyl]isonipecotic acid ethyl ester Formula: C28H31N3O4 MolecularWeight: 473.56344

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C(C)N2C(C3=CC=CC=C3C2=O)C4=CN(C5=CC=CC=C54)C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C(C)N2C(C3=CC=CC=C3C2=O)C4=CN(C5=CC=CC=C54)C

InChI

InChI=1S/C28H31N3O4/c1-4-35-28(34)19-13-15-30(16-14-19)26(32)18(2)31-25(21-10-5-6-11-22(21)27(31)33)23-17-29(3)24-12-8-7-9-20(23)24/h5-12,17-19,25H,4,13-16H2,1-3H3