[4-[(2,6-dinitro-4-piperidin-1-ylcarbonyl-phenyl)amino]phenyl] 3-oxidanylnaphthalene-2-carboxylate

Systemtic Name: [4-[(2,6-dinitro-4-piperidin-1-ylcarbonyl-phenyl)amino]phenyl] 3-oxidanylnaphthalene-2-carboxylate Openeye Name: [4-[2,6-dinitro-4-(piperidine-1-carbonyl)anilino]phenyl] 3-hydroxynaphthalene-2-carboxylate CAS Name: 3-hydroxy-2-naphthalenecarboxylic acid [4-[2,6-dinitro-4-[oxo(1-piperidinyl)methyl]anilino]phenyl] ester IUPAC Name: [4-[2,6-dinitro-4-(piperidine-1-carbonyl)anilino]phenyl] 3-hydroxynaphthalene-2-carboxylate Traditional Name: 3-hydroxynaphthalene-2-carboxylic acid [4-[2,6-dinitro-4-(piperidine-1-carbonyl)anilino]phenyl] ester Formula: C29H24N4O8 MolecularWeight: 556.52286

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2=CC(=C(C(=C2)[N+](=O)[O-])NC3=CC=C(C=C3)OC(=O)C4=CC5=CC=CC=C5C=C4O)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C(=O)C2=CC(=C(C(=C2)[N+](=O)[O-])NC3=CC=C(C=C3)OC(=O)C4=CC5=CC=CC=C5C=C4O)[N+](=O)[O-]

InChI

InChI=1S/C29H24N4O8/c34-26-17-19-7-3-2-6-18(19)14-23(26)29(36)41-22-10-8-21(9-11-22)30-27-24(32(37)38)15-20(16-25(27)33(39)40)28(35)31-12-4-1-5-13-31/h2-3,6-11,14-17,30,34H,1,4-5,12-13H2