[1-(cyclohexylamino)-1-oxidanylidene-propan-2-yl] 2-(2-oxidanylidene-3-propyl-benzimidazol-1-yl)ethanoate

Systemtic Name: [1-(cyclohexylamino)-1-oxidanylidene-propan-2-yl] 2-(2-oxidanylidene-3-propyl-benzimidazol-1-yl)ethanoate Openeye Name: [2-(cyclohexylamino)-1-methyl-2-oxo-ethyl] 2-(2-oxo-3-propyl-benzimidazol-1-yl)acetate CAS Name: 2-(2-oxo-3-propyl-1-benzimidazolyl)acetic acid [1-(cyclohexylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(cyclohexylamino)-1-oxopropan-2-yl] 2-(2-oxo-3-propylbenzimidazol-1-yl)acetate Traditional Name: 2-(2-keto-3-propyl-benzimidazol-1-yl)acetic acid [2-(cyclohexylamino)-2-keto-1-methyl-ethyl] ester Formula: C21H29N3O4 MolecularWeight: 387.47266

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=CC=CC=C2N(C1=O)CC(=O)OC(C)C(=O)NC3CCCCC3

Isomeric SMILES

CCCN1C2=CC=CC=C2N(C1=O)CC(=O)OC(C)C(=O)NC3CCCCC3

InChI

InChI=1S/C21H29N3O4/c1-3-13-23-17-11-7-8-12-18(17)24(21(23)27)14-19(25)28-15(2)20(26)22-16-9-5-4-6-10-16/h7-8,11-12,15-16H,3-6,9-10,13-14H2,1-2H3,(H,22,26)