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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=C(C=C(C=C2)C(=O)NC3=C(C=CC(=C3)C(=O)OC)C)[N+](=O)[O-]

Isomeric SMILES

C[C@@H]1CCCN(C1)C2=C(C=C(C=C2)C(=O)NC3=C(C=CC(=C3)C(=O)OC)C)[N+](=O)[O-]

InChI

InChI=1S/C22H25N3O5/c1-14-5-4-10-24(13-14)19-9-8-16(12-20(19)25(28)29)21(26)23-18-11-17(22(27)30-3)7-6-15(18)2/h6-9,11-12,14H,4-5,10,13H2,1-3H3,(H,23,26)/t14-/m1/s1