methyl 4,5-dimethoxy-2-[[4-[(3S)-3-methylpiperidin-1-yl]-3-nitro-phenyl]carbonylamino]benzoate

Systemtic Name: methyl 4,5-dimethoxy-2-[[4-[(3S)-3-methylpiperidin-1-yl]-3-nitro-phenyl]carbonylamino]benzoate Openeye Name: methyl 4,5-dimethoxy-2-[[4-[(3S)-3-methyl-1-piperidyl]-3-nitro-benzoyl]amino]benzoate CAS Name: 4,5-dimethoxy-2-[[[4-[(3S)-3-methyl-1-piperidinyl]-3-nitrophenyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4,5-dimethoxy-2-[[4-[(3S)-3-methylpiperidin-1-yl]-3-nitrobenzoyl]amino]benzoate Traditional Name: 4,5-dimethoxy-2-[[4-[(3S)-3-methylpiperidino]-3-nitro-benzoyl]amino]benzoic acid methyl ester Formula: C23H27N3O7 MolecularWeight: 457.47638

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@H]1CCCN(C1)C2=C(C=C(C=C2)C(=O)NC3=CC(=C(C=C3C(=O)OC)OC)OC)[N+](=O)[O-]

InChI

InChI=1S/C23H27N3O7/c1-14-6-5-9-25(13-14)18-8-7-15(10-19(18)26(29)30)22(27)24-17-12-21(32-3)20(31-2)11-16(17)23(28)33-4/h7-8,10-12,14H,5-6,9,13H2,1-4H3,(H,24,27)/t14-/m0/s1