methyl 2-[(5-methyl-1H-imidazol-4-yl)methyl-(3-phenylpropyl)carbamoyl]benzoate

Systemtic Name: methyl 2-[(5-methyl-1H-imidazol-4-yl)methyl-(3-phenylpropyl)carbamoyl]benzoate Openeye Name: methyl 2-[(5-methyl-1H-imidazol-4-yl)methyl-(3-phenylpropyl)carbamoyl]benzoate CAS Name: 2-[[(5-methyl-1H-imidazol-4-yl)methyl-(3-phenylpropyl)amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 2-[(5-methyl-1H-imidazol-4-yl)methyl-(3-phenylpropyl)carbamoyl]benzoate Traditional Name: 2-[(5-methyl-1H-imidazol-4-yl)methyl-(3-phenylpropyl)carbamoyl]benzoic acid methyl ester Formula: C23H25N3O3 MolecularWeight: 391.4629

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CN1)CN(CCCC2=CC=CC=C2)C(=O)C3=CC=CC=C3C(=O)OC

Isomeric SMILES

CC1=C(N=CN1)CN(CCCC2=CC=CC=C2)C(=O)C3=CC=CC=C3C(=O)OC

InChI

InChI=1S/C23H25N3O3/c1-17-21(25-16-24-17)15-26(14-8-11-18-9-4-3-5-10-18)22(27)19-12-6-7-13-20(19)23(28)29-2/h3-7,9-10,12-13,16H,8,11,14-15H2,1-2H3,(H,24,25)