N-(2-ethanoylphenyl)-4-(3-methylpiperidin-1-yl)-3-nitro-benzamide

Systemtic Name: N-(2-ethanoylphenyl)-4-(3-methylpiperidin-1-yl)-3-nitro-benzamide Openeye Name: N-(2-acetylphenyl)-4-(3-methyl-1-piperidyl)-3-nitro-benzamide CAS Name: N-(2-acetylphenyl)-4-(3-methyl-1-piperidinyl)-3-nitrobenzamide IUPAC Name: N-(2-acetylphenyl)-4-(3-methylpiperidin-1-yl)-3-nitrobenzamide Traditional Name: N-(2-acetylphenyl)-4-(3-methylpiperidino)-3-nitro-benzamide Formula: C21H23N3O4 MolecularWeight: 381.42502

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=C(C=C(C=C2)C(=O)NC3=CC=CC=C3C(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC1CCCN(C1)C2=C(C=C(C=C2)C(=O)NC3=CC=CC=C3C(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C21H23N3O4/c1-14-6-5-11-23(13-14)19-10-9-16(12-20(19)24(27)28)21(26)22-18-8-4-3-7-17(18)15(2)25/h3-4,7-10,12,14H,5-6,11,13H2,1-2H3,(H,22,26)