methyl 4-methyl-3-[[4-(4-methylpiperidin-1-yl)-3-nitro-phenyl]carbonylamino]benzoate

Systemtic Name: methyl 4-methyl-3-[[4-(4-methylpiperidin-1-yl)-3-nitro-phenyl]carbonylamino]benzoate Openeye Name: methyl 4-methyl-3-[[4-(4-methyl-1-piperidyl)-3-nitro-benzoyl]amino]benzoate CAS Name: 4-methyl-3-[[[4-(4-methyl-1-piperidinyl)-3-nitrophenyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-[[4-(4-methylpiperidin-1-yl)-3-nitrobenzoyl]amino]benzoate Traditional Name: 4-methyl-3-[[4-(4-methylpiperidino)-3-nitro-benzoyl]amino]benzoic acid methyl ester Formula: C22H25N3O5 MolecularWeight: 411.451

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=C(C=CC(=C3)C(=O)OC)C)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=C(C=CC(=C3)C(=O)OC)C)[N+](=O)[O-]

InChI

InChI=1S/C22H25N3O5/c1-14-8-10-24(11-9-14)19-7-6-16(13-20(19)25(28)29)21(26)23-18-12-17(22(27)30-3)5-4-15(18)2/h4-7,12-14H,8-11H2,1-3H3,(H,23,26)