N-[(1S)-1-(4-imidazol-1-ylphenyl)ethyl]-2-methyl-3-nitro-benzamide

Systemtic Name: N-[(1S)-1-(4-imidazol-1-ylphenyl)ethyl]-2-methyl-3-nitro-benzamide Openeye Name: N-[(1S)-1-(4-imidazol-1-ylphenyl)ethyl]-2-methyl-3-nitro-benzamide CAS Name: N-[(1S)-1-[4-(1-imidazolyl)phenyl]ethyl]-2-methyl-3-nitrobenzamide IUPAC Name: N-[(1S)-1-(4-imidazol-1-ylphenyl)ethyl]-2-methyl-3-nitrobenzamide Traditional Name: N-[(1S)-1-(4-imidazol-1-ylphenyl)ethyl]-2-methyl-3-nitro-benzamide Formula: C19H18N4O3 MolecularWeight: 350.37122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC(C)C2=CC=C(C=C2)N3C=CN=C3

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)N[C@@H](C)C2=CC=C(C=C2)N3C=CN=C3

InChI

InChI=1S/C19H18N4O3/c1-13-17(4-3-5-18(13)23(25)26)19(24)21-14(2)15-6-8-16(9-7-15)22-11-10-20-12-22/h3-12,14H,1-2H3,(H,21,24)/t14-/m0/s1