[1-[(2,3-dimethylcyclohexyl)amino]-1-oxidanylidene-propan-2-yl] 2-(2-methylbenzimidazol-1-yl)ethanoate

Systemtic Name: [1-[(2,3-dimethylcyclohexyl)amino]-1-oxidanylidene-propan-2-yl] 2-(2-methylbenzimidazol-1-yl)ethanoate Openeye Name: [2-[(2,3-dimethylcyclohexyl)amino]-1-methyl-2-oxo-ethyl] 2-(2-methylbenzimidazol-1-yl)acetate CAS Name: 2-(2-methyl-1-benzimidazolyl)acetic acid [1-[(2,3-dimethylcyclohexyl)amino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[(2,3-dimethylcyclohexyl)amino]-1-oxopropan-2-yl] 2-(2-methylbenzimidazol-1-yl)acetate Traditional Name: 2-(2-methylbenzimidazol-1-yl)acetic acid [2-[(2,3-dimethylcyclohexyl)amino]-2-keto-1-methyl-ethyl] ester Formula: C21H29N3O3 MolecularWeight: 371.47326

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)NC(=O)C(C)OC(=O)CN2C(=NC3=CC=CC=C32)C

Isomeric SMILES

CC1CCCC(C1C)NC(=O)C(C)OC(=O)CN2C(=NC3=CC=CC=C32)C

InChI

InChI=1S/C21H29N3O3/c1-13-8-7-10-17(14(13)2)23-21(26)15(3)27-20(25)12-24-16(4)22-18-9-5-6-11-19(18)24/h5-6,9,11,13-15,17H,7-8,10,12H2,1-4H3,(H,23,26)