N-methyl-N-[[4-(methylcarbamoyl)phenyl]methyl]-4-[(3S)-3-methylpiperidin-1-yl]-3-nitro-benzamide

Systemtic Name: N-methyl-N-[[4-(methylcarbamoyl)phenyl]methyl]-4-[(3S)-3-methylpiperidin-1-yl]-3-nitro-benzamide Openeye Name: N-methyl-N-[[4-(methylcarbamoyl)phenyl]methyl]-4-[(3S)-3-methyl-1-piperidyl]-3-nitro-benzamide CAS Name: N-methyl-N-[[4-(methylcarbamoyl)phenyl]methyl]-4-[(3S)-3-methyl-1-piperidinyl]-3-nitrobenzamide IUPAC Name: N-methyl-N-[[4-(methylcarbamoyl)phenyl]methyl]-4-[(3S)-3-methylpiperidin-1-yl]-3-nitrobenzamide Traditional Name: N-methyl-N-[4-(methylcarbamoyl)benzyl]-4-[(3S)-3-methylpiperidino]-3-nitro-benzamide Formula: C23H28N4O4 MolecularWeight: 424.49282

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=C(C=C(C=C2)C(=O)N(C)CC3=CC=C(C=C3)C(=O)NC)[N+](=O)[O-]

Isomeric SMILES

C[C@H]1CCCN(C1)C2=C(C=C(C=C2)C(=O)N(C)CC3=CC=C(C=C3)C(=O)NC)[N+](=O)[O-]

InChI

InChI=1S/C23H28N4O4/c1-16-5-4-12-26(14-16)20-11-10-19(13-21(20)27(30)31)23(29)25(3)15-17-6-8-18(9-7-17)22(28)24-2/h6-11,13,16H,4-5,12,14-15H2,1-3H3,(H,24,28)/t16-/m0/s1