[chloranyl(phenyl)carbamoyl] 2-butyl-5-imidazol-1-yl-4-(2-methoxy-2-oxidanylidene-ethyl)-3-methyl-benzoate

Systemtic Name: [chloranyl(phenyl)carbamoyl] 2-butyl-5-imidazol-1-yl-4-(2-methoxy-2-oxidanylidene-ethyl)-3-methyl-benzoate Openeye Name: [chloro(phenyl)carbamoyl] 2-butyl-5-imidazol-1-yl-4-(2-methoxy-2-oxo-ethyl)-3-methyl-benzoate CAS Name: 2-butyl-5-(1-imidazolyl)-4-(2-methoxy-2-oxoethyl)-3-methylbenzoic acid [(N-chloroanilino)-oxomethyl] ester IUPAC Name: [chloro(phenyl)carbamoyl] 2-butyl-5-imidazol-1-yl-4-(2-methoxy-2-oxoethyl)-3-methylbenzoate Traditional Name: 2-butyl-5-imidazol-1-yl-4-(2-keto-2-methoxy-ethyl)-3-methyl-benzoic acid [chloro(phenyl)carbamoyl] ester Formula: C25H26ClN3O5 MolecularWeight: 483.94404

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=C(C=C1C(=O)OC(=O)N(C2=CC=CC=C2)Cl)N3C=CN=C3)CC(=O)OC)C

Isomeric SMILES

CCCCC1=C(C(=C(C=C1C(=O)OC(=O)N(C2=CC=CC=C2)Cl)N3C=CN=C3)CC(=O)OC)C

InChI

InChI=1S/C25H26ClN3O5/c1-4-5-11-19-17(2)20(15-23(30)33-3)22(28-13-12-27-16-28)14-21(19)24(31)34-25(32)29(26)18-9-7-6-8-10-18/h6-10,12-14,16H,4-5,11,15H2,1-3H3