N-[(4-aminocarbonylphenyl)methyl]-4-imidazol-1-yl-3-nitro-benzamide

Systemtic Name: N-[(4-aminocarbonylphenyl)methyl]-4-imidazol-1-yl-3-nitro-benzamide Openeye Name: N-[(4-carbamoylphenyl)methyl]-4-imidazol-1-yl-3-nitro-benzamide CAS Name: N-[(4-carbamoylphenyl)methyl]-4-(1-imidazolyl)-3-nitrobenzamide IUPAC Name: N-[(4-carbamoylphenyl)methyl]-4-imidazol-1-yl-3-nitrobenzamide Traditional Name: N-(4-carbamoylbenzyl)-4-imidazol-1-yl-3-nitro-benzamide Formula: C18H15N5O4 MolecularWeight: 365.3428

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)C2=CC(=C(C=C2)N3C=CN=C3)[N+](=O)[O-])C(=O)N

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)C2=CC(=C(C=C2)N3C=CN=C3)[N+](=O)[O-])C(=O)N

InChI

InChI=1S/C18H15N5O4/c19-17(24)13-3-1-12(2-4-13)10-21-18(25)14-5-6-15(16(9-14)23(26)27)22-8-7-20-11-22/h1-9,11H,10H2,(H2,19,24)(H,21,25)