(diphenylmethyl) 3-nitro-4-piperidin-1-yl-benzoate

Systemtic Name: (diphenylmethyl) 3-nitro-4-piperidin-1-yl-benzoate Openeye Name: benzhydryl 3-nitro-4-(1-piperidyl)benzoate CAS Name: 3-nitro-4-(1-piperidinyl)benzoic acid (diphenylmethyl) ester IUPAC Name: benzhydryl 3-nitro-4-piperidin-1-ylbenzoate Traditional Name: 3-nitro-4-piperidino-benzoic acid benzhydryl ester Formula: C25H24N2O4 MolecularWeight: 416.46906

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H24N2O4/c28-25(31-24(19-10-4-1-5-11-19)20-12-6-2-7-13-20)21-14-15-22(23(18-21)27(29)30)26-16-8-3-9-17-26/h1-2,4-7,10-15,18,24H,3,8-9,16-17H2