methyl 2-[[2-butyl-3-[(2-chlorophenyl)methyl]imidazol-4-yl]methylamino]-2-methyl-3-phenyl-propanoate

Systemtic Name: methyl 2-[[2-butyl-3-[(2-chlorophenyl)methyl]imidazol-4-yl]methylamino]-2-methyl-3-phenyl-propanoate Openeye Name: methyl 2-[[2-butyl-3-[(2-chlorophenyl)methyl]imidazol-4-yl]methylamino]-2-methyl-3-phenyl-propanoate CAS Name: 2-[[2-butyl-3-[(2-chlorophenyl)methyl]-4-imidazolyl]methylamino]-2-methyl-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 2-[[2-butyl-3-[(2-chlorophenyl)methyl]imidazol-4-yl]methylamino]-2-methyl-3-phenylpropanoate Traditional Name: 2-[[2-butyl-3-(2-chlorobenzyl)imidazol-4-yl]methylamino]-2-methyl-3-phenyl-propionic acid methyl ester Formula: C26H32ClN3O2 MolecularWeight: 454.00418

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC=C(N1CC2=CC=CC=C2Cl)CNC(C)(CC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CCCCC1=NC=C(N1CC2=CC=CC=C2Cl)CNC(C)(CC3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C26H32ClN3O2/c1-4-5-15-24-28-17-22(30(24)19-21-13-9-10-14-23(21)27)18-29-26(2,25(31)32-3)16-20-11-7-6-8-12-20/h6-14,17,29H,4-5,15-16,18-19H2,1-3H3