N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-4-(3-methylpiperidin-1-yl)-3-nitro-benzamide

Systemtic Name: N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-4-(3-methylpiperidin-1-yl)-3-nitro-benzamide Openeye Name: N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-4-(3-methyl-1-piperidyl)-3-nitro-benzamide CAS Name: N-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]-4-(3-methyl-1-piperidinyl)-3-nitrobenzamide IUPAC Name: N-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]-4-(3-methylpiperidin-1-yl)-3-nitrobenzamide Traditional Name: N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-4-(3-methylpiperidino)-3-nitro-benzamide Formula: C23H28N4O7 MolecularWeight: 472.49102

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=C(C=C(C=C2)C(=O)NCCC3=CC(=C(C=C3[N+](=O)[O-])OC)OC)[N+](=O)[O-]

Isomeric SMILES

CC1CCCN(C1)C2=C(C=C(C=C2)C(=O)NCCC3=CC(=C(C=C3[N+](=O)[O-])OC)OC)[N+](=O)[O-]

InChI

InChI=1S/C23H28N4O7/c1-15-5-4-10-25(14-15)18-7-6-17(11-20(18)27(31)32)23(28)24-9-8-16-12-21(33-2)22(34-3)13-19(16)26(29)30/h6-7,11-13,15H,4-5,8-10,14H2,1-3H3,(H,24,28)