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

Systemtic Name: 2-[5-[ethyl-[(3-methoxyphenyl)methyl]amino]pentyl]-5-nitro-isoindole-1,3-dione Openeye Name: 2-[5-[ethyl-[(3-methoxyphenyl)methyl]amino]pentyl]-5-nitro-isoindoline-1,3-dione CAS Name: 2-[5-[ethyl-[(3-methoxyphenyl)methyl]amino]pentyl]-5-nitroisoindole-1,3-dione IUPAC Name: 2-[5-[ethyl-[(3-methoxyphenyl)methyl]amino]pentyl]-5-nitroisoindole-1,3-dione Traditional Name: 2-[5-[ethyl(m-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=C3)OC

Isomeric SMILES

CCN(CCCCCN1C(=O)C2=C(C1=O)C=C(C=C2)[N+](=O)[O-])CC3=CC(=CC=C3)OC

InChI

InChI=1S/C23H27N3O5/c1-3-24(16-17-8-7-9-19(14-17)31-2)12-5-4-6-13-25-22(27)20-11-10-18(26(29)30)15-21(20)23(25)28/h7-11,14-15H,3-6,12-13,16H2,1-2H3