[1-[(2-methylphenyl)amino]-1-oxidanylidene-butan-2-yl] 4-(1H-imidazol-2-yl)benzoate

Systemtic Name: [1-[(2-methylphenyl)amino]-1-oxidanylidene-butan-2-yl] 4-(1H-imidazol-2-yl)benzoate Openeye Name: 1-(o-tolylcarbamoyl)propyl 4-(1H-imidazol-2-yl)benzoate CAS Name: 4-(1H-imidazol-2-yl)benzoic acid [1-(2-methylanilino)-1-oxobutan-2-yl] ester IUPAC Name: [1-(2-methylanilino)-1-oxobutan-2-yl] 4-(1H-imidazol-2-yl)benzoate Traditional Name: 4-(1H-imidazol-2-yl)benzoic acid 1-(o-tolylcarbamoyl)propyl ester Formula: C21H21N3O3 MolecularWeight: 363.40974

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC=C1C)OC(=O)C2=CC=C(C=C2)C3=NC=CN3

Isomeric SMILES

CCC(C(=O)NC1=CC=CC=C1C)OC(=O)C2=CC=C(C=C2)C3=NC=CN3

InChI

InChI=1S/C21H21N3O3/c1-3-18(20(25)24-17-7-5-4-6-14(17)2)27-21(26)16-10-8-15(9-11-16)19-22-12-13-23-19/h4-13,18H,3H2,1-2H3,(H,22,23)(H,24,25)