dimethyl 7-[4-[1,3-bis(oxidanylidene)isoindol-2-yl]butylamino]naphthalene-1,2-dicarboxylate

Systemtic Name: dimethyl 7-[4-[1,3-bis(oxidanylidene)isoindol-2-yl]butylamino]naphthalene-1,2-dicarboxylate Openeye Name: dimethyl 7-[4-(1,3-dioxoisoindolin-2-yl)butylamino]naphthalene-1,2-dicarboxylate CAS Name: 7-[4-(1,3-dioxo-2-isoindolyl)butylamino]naphthalene-1,2-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 7-[4-(1,3-dioxoisoindol-2-yl)butylamino]naphthalene-1,2-dicarboxylate Traditional Name: 7-(4-phthalimidobutylamino)naphthalene-1,2-dicarboxylic acid dimethyl ester Formula: C26H24N2O6 MolecularWeight: 460.47856

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=C(C=CC(=C2)NCCCCN3C(=O)C4=CC=CC=C4C3=O)C=C1)C(=O)OC

Isomeric SMILES

COC(=O)C1=C(C2=C(C=CC(=C2)NCCCCN3C(=O)C4=CC=CC=C4C3=O)C=C1)C(=O)OC

InChI

InChI=1S/C26H24N2O6/c1-33-25(31)20-12-10-16-9-11-17(15-21(16)22(20)26(32)34-2)27-13-5-6-14-28-23(29)18-7-3-4-8-19(18)24(28)30/h3-4,7-12,15,27H,5-6,13-14H2,1-2H3