N-[3-(benzimidazol-1-yl)propyl]-3-methyl-4-nitro-benzamide

Systemtic Name: N-[3-(benzimidazol-1-yl)propyl]-3-methyl-4-nitro-benzamide Openeye Name: N-[3-(benzimidazol-1-yl)propyl]-3-methyl-4-nitro-benzamide CAS Name: N-[3-(1-benzimidazolyl)propyl]-3-methyl-4-nitrobenzamide IUPAC Name: N-[3-(benzimidazol-1-yl)propyl]-3-methyl-4-nitrobenzamide Traditional Name: N-[3-(benzimidazol-1-yl)propyl]-3-methyl-4-nitro-benzamide Formula: C18H18N4O3 MolecularWeight: 338.36052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NCCCN2C=NC3=CC=CC=C32)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NCCCN2C=NC3=CC=CC=C32)[N+](=O)[O-]

InChI

InChI=1S/C18H18N4O3/c1-13-11-14(7-8-16(13)22(24)25)18(23)19-9-4-10-21-12-20-15-5-2-3-6-17(15)21/h2-3,5-8,11-12H,4,9-10H2,1H3,(H,19,23)