2-[2-[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]ethyl]-5-nitro-isoindole-1,3-dione

Systemtic Name: 2-[2-[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]ethyl]-5-nitro-isoindole-1,3-dione Openeye Name: 2-[2-[1-[(4-methoxyphenyl)methyl]-4-piperidyl]ethyl]-5-nitro-isoindoline-1,3-dione CAS Name: 2-[2-[1-[(4-methoxyphenyl)methyl]-4-piperidinyl]ethyl]-5-nitroisoindole-1,3-dione IUPAC Name: 2-[2-[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]ethyl]-5-nitroisoindole-1,3-dione Traditional Name: 5-nitro-2-[2-(1-p-anisyl-4-piperidyl)ethyl]isoindoline-1,3-quinone Formula: C23H25N3O5 MolecularWeight: 423.4617

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2CCC(CC2)CCN3C(=O)C4=C(C3=O)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)CN2CCC(CC2)CCN3C(=O)C4=C(C3=O)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H25N3O5/c1-31-19-5-2-17(3-6-19)15-24-11-8-16(9-12-24)10-13-25-22(27)20-7-4-18(26(29)30)14-21(20)23(25)28/h2-7,14,16H,8-13,15H2,1H3