ethyl 4-[[2-[1-(1H-indol-3-yl)-3-oxidanylidene-1H-isoindol-2-yl]-3-methyl-pentanoyl]amino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[2-[1-(1H-indol-3-yl)-3-oxidanylidene-1H-isoindol-2-yl]-3-methyl-pentanoyl]amino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[2-[1-(1H-indol-3-yl)-3-oxo-isoindolin-2-yl]-3-methyl-pentanoyl]amino]piperidine-1-carboxylate CAS Name: 4-[[2-[1-(1H-indol-3-yl)-3-oxo-1H-isoindol-2-yl]-3-methyl-1-oxopentyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[2-[1-(1H-indol-3-yl)-3-oxo-1H-isoindol-2-yl]-3-methylpentanoyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[2-[1-(1H-indol-3-yl)-3-keto-isoindolin-2-yl]-3-methyl-pentanoyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C30H36N4O4 MolecularWeight: 516.63124

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC1CCN(CC1)C(=O)OCC)N2C(C3=CC=CC=C3C2=O)C4=CNC5=CC=CC=C54

Isomeric SMILES

CCC(C)C(C(=O)NC1CCN(CC1)C(=O)OCC)N2C(C3=CC=CC=C3C2=O)C4=CNC5=CC=CC=C54

InChI

InChI=1S/C30H36N4O4/c1-4-19(3)26(28(35)32-20-14-16-33(17-15-20)30(37)38-5-2)34-27(22-11-6-7-12-23(22)29(34)36)24-18-31-25-13-9-8-10-21(24)25/h6-13,18-20,26-27,31H,4-5,14-17H2,1-3H3,(H,32,35)