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

Systemtic Name: methyl 3-[(4-methoxy-3-nitro-phenyl)carbonylamino]-4-(4-methylpiperazin-1-yl)benzoate Openeye Name: methyl 3-[(4-methoxy-3-nitro-benzoyl)amino]-4-(4-methylpiperazin-1-yl)benzoate CAS Name: 3-[[(4-methoxy-3-nitrophenyl)-oxomethyl]amino]-4-(4-methyl-1-piperazinyl)benzoic acid methyl ester IUPAC Name: methyl 3-[(4-methoxy-3-nitrobenzoyl)amino]-4-(4-methylpiperazin-1-yl)benzoate Traditional Name: 3-[(4-methoxy-3-nitro-benzoyl)amino]-4-(4-methylpiperazino)benzoic acid methyl ester Formula: C21H24N4O6 MolecularWeight: 428.43846

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C=C(C=C2)C(=O)OC)NC(=O)C3=CC(=C(C=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)C2=C(C=C(C=C2)C(=O)OC)NC(=O)C3=CC(=C(C=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C21H24N4O6/c1-23-8-10-24(11-9-23)17-6-4-15(21(27)31-3)12-16(17)22-20(26)14-5-7-19(30-2)18(13-14)25(28)29/h4-7,12-13H,8-11H2,1-3H3,(H,22,26)