methyl 4-cyano-4-[[2-[(1-methylindol-2-yl)carbonylamino]cyclohexyl]carbonylamino]butanoate

Systemtic Name: methyl 4-cyano-4-[[2-[(1-methylindol-2-yl)carbonylamino]cyclohexyl]carbonylamino]butanoate Openeye Name: methyl 4-cyano-4-[[2-[(1-methylindole-2-carbonyl)amino]cyclohexanecarbonyl]amino]butanoate CAS Name: 4-cyano-4-[[[2-[[(1-methyl-2-indolyl)-oxomethyl]amino]cyclohexyl]-oxomethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-cyano-4-[[2-[(1-methylindole-2-carbonyl)amino]cyclohexanecarbonyl]amino]butanoate Traditional Name: 4-cyano-4-[[2-[(1-methylindole-2-carbonyl)amino]cyclohexanecarbonyl]amino]butyric acid methyl ester Formula: C23H28N4O4 MolecularWeight: 424.49282

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C=C1C(=O)NC3CCCCC3C(=O)NC(CCC(=O)OC)C#N

Isomeric SMILES

CN1C2=CC=CC=C2C=C1C(=O)NC3CCCCC3C(=O)NC(CCC(=O)OC)C#N

InChI

InChI=1S/C23H28N4O4/c1-27-19-10-6-3-7-15(19)13-20(27)23(30)26-18-9-5-4-8-17(18)22(29)25-16(14-24)11-12-21(28)31-2/h3,6-7,10,13,16-18H,4-5,8-9,11-12H2,1-2H3,(H,25,29)(H,26,30)