4-methyl-N-(3-nitro-4-piperazin-1-yl-phenyl)benzamide

Systemtic Name: 4-methyl-N-(3-nitro-4-piperazin-1-yl-phenyl)benzamide Openeye Name: 4-methyl-N-(3-nitro-4-piperazin-1-yl-phenyl)benzamide CAS Name: 4-methyl-N-[3-nitro-4-(1-piperazinyl)phenyl]benzamide IUPAC Name: 4-methyl-N-(3-nitro-4-piperazin-1-ylphenyl)benzamide Traditional Name: 4-methyl-N-(3-nitro-4-piperazino-phenyl)benzamide Formula: C18H20N4O3 MolecularWeight: 340.3764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)N3CCNCC3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)N3CCNCC3)[N+](=O)[O-]

InChI

InChI=1S/C18H20N4O3/c1-13-2-4-14(5-3-13)18(23)20-15-6-7-16(17(12-15)22(24)25)21-10-8-19-9-11-21/h2-7,12,19H,8-11H2,1H3,(H,20,23)