2-[5-[ethyl-[(2-methoxyphenyl)methyl]amino]pentyl]-5-nitro-isoindole-1,3-dione

Systemtic Name: 2-[5-[ethyl-[(2-methoxyphenyl)methyl]amino]pentyl]-5-nitro-isoindole-1,3-dione Openeye Name: 2-[5-[ethyl-[(2-methoxyphenyl)methyl]amino]pentyl]-5-nitro-isoindoline-1,3-dione CAS Name: 2-[5-[ethyl-[(2-methoxyphenyl)methyl]amino]pentyl]-5-nitroisoindole-1,3-dione IUPAC Name: 2-[5-[ethyl-[(2-methoxyphenyl)methyl]amino]pentyl]-5-nitroisoindole-1,3-dione Traditional Name: 2-[5-[ethyl(o-anisyl)amino]pentyl]-5-nitro-isoindoline-1,3-quinone Formula: C23H27N3O5 MolecularWeight: 425.47758

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCCCN1C(=O)C2=C(C1=O)C=C(C=C2)[N+](=O)[O-])CC3=CC=CC=C3OC

Isomeric SMILES

CCN(CCCCCN1C(=O)C2=C(C1=O)C=C(C=C2)[N+](=O)[O-])CC3=CC=CC=C3OC

InChI

InChI=1S/C23H27N3O5/c1-3-24(16-17-9-5-6-10-21(17)31-2)13-7-4-8-14-25-22(27)19-12-11-18(26(29)30)15-20(19)23(25)28/h5-6,9-12,15H,3-4,7-8,13-14,16H2,1-2H3