(Z)-3-(1H-imidazol-5-yl)-4-(3-nitrophenyl)-2-(phenylmethyl)but-2-enoic acid

Systemtic Name: (Z)-3-(1H-imidazol-5-yl)-4-(3-nitrophenyl)-2-(phenylmethyl)but-2-enoic acid Openeye Name: (Z)-2-benzyl-3-(1H-imidazol-5-yl)-4-(3-nitrophenyl)but-2-enoic acid CAS Name: (Z)-3-(1H-imidazol-5-yl)-4-(3-nitrophenyl)-2-(phenylmethyl)-2-butenoic acid IUPAC Name: (Z)-2-benzyl-3-(1H-imidazol-5-yl)-4-(3-nitrophenyl)but-2-enoic acid Traditional Name: (Z)-2-benzyl-3-(1H-imidazol-5-yl)-4-(3-nitrophenyl)but-2-enoic acid Formula: C20H17N3O4 MolecularWeight: 363.36668

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(=C(CC2=CC(=CC=C2)[N+](=O)[O-])C3=CN=CN3)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C/C(=C(\CC2=CC(=CC=C2)[N+](=O)[O-])/C3=CN=CN3)/C(=O)O

InChI

InChI=1S/C20H17N3O4/c24-20(25)18(10-14-5-2-1-3-6-14)17(19-12-21-13-22-19)11-15-7-4-8-16(9-15)23(26)27/h1-9,12-13H,10-11H2,(H,21,22)(H,24,25)/b18-17-