methyl 2-phenyl-4-[[3-(phenylmethyl)imidazol-4-yl]methylamino]benzoate

Systemtic Name: methyl 2-phenyl-4-[[3-(phenylmethyl)imidazol-4-yl]methylamino]benzoate Openeye Name: methyl 4-[(3-benzylimidazol-4-yl)methylamino]-2-phenyl-benzoate CAS Name: 2-phenyl-4-[[3-(phenylmethyl)-4-imidazolyl]methylamino]benzoic acid methyl ester IUPAC Name: methyl 4-[(3-benzylimidazol-4-yl)methylamino]-2-phenylbenzoate Traditional Name: 4-[(3-benzylimidazol-4-yl)methylamino]-2-phenyl-benzoic acid methyl ester Formula: C25H23N3O2 MolecularWeight: 397.46902

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=C(C=C1)NCC2=CN=CN2CC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=C(C=C(C=C1)NCC2=CN=CN2CC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H23N3O2/c1-30-25(29)23-13-12-21(14-24(23)20-10-6-3-7-11-20)27-16-22-15-26-18-28(22)17-19-8-4-2-5-9-19/h2-15,18,27H,16-17H2,1H3