methyl 2-[(1-methylimidazol-2-yl)methyl-[(2R)-4-phenylbutan-2-yl]carbamoyl]benzoate

Systemtic Name: methyl 2-[(1-methylimidazol-2-yl)methyl-[(2R)-4-phenylbutan-2-yl]carbamoyl]benzoate Openeye Name: methyl 2-[(1-methylimidazol-2-yl)methyl-[(1R)-1-methyl-3-phenyl-propyl]carbamoyl]benzoate CAS Name: 2-[[(1-methyl-2-imidazolyl)methyl-[(2R)-4-phenylbutan-2-yl]amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 2-[(1-methylimidazol-2-yl)methyl-[(2R)-4-phenylbutan-2-yl]carbamoyl]benzoate Traditional Name: 2-[(1-methylimidazol-2-yl)methyl-[(1R)-1-methyl-3-phenyl-propyl]carbamoyl]benzoic acid methyl ester Formula: C24H27N3O3 MolecularWeight: 405.48948

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)N(CC2=NC=CN2C)C(=O)C3=CC=CC=C3C(=O)OC

Isomeric SMILES

C[C@H](CCC1=CC=CC=C1)N(CC2=NC=CN2C)C(=O)C3=CC=CC=C3C(=O)OC

InChI

InChI=1S/C24H27N3O3/c1-18(13-14-19-9-5-4-6-10-19)27(17-22-25-15-16-26(22)2)23(28)20-11-7-8-12-21(20)24(29)30-3/h4-12,15-16,18H,13-14,17H2,1-3H3/t18-/m1/s1