[1-(naphthalen-2-ylamino)-1-oxidanylidene-propan-2-yl] 4-[1,3-bis(oxidanylidene)isoindol-2-yl]butanoate

Systemtic Name: [1-(naphthalen-2-ylamino)-1-oxidanylidene-propan-2-yl] 4-[1,3-bis(oxidanylidene)isoindol-2-yl]butanoate Openeye Name: [1-methyl-2-(2-naphthylamino)-2-oxo-ethyl] 4-(1,3-dioxoisoindolin-2-yl)butanoate CAS Name: 4-(1,3-dioxo-2-isoindolyl)butanoic acid [1-(2-naphthalenylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(naphthalen-2-ylamino)-1-oxopropan-2-yl] 4-(1,3-dioxoisoindol-2-yl)butanoate Traditional Name: 4-phthalimidobutyric acid [2-keto-1-methyl-2-(2-naphthylamino)ethyl] ester Formula: C25H22N2O5 MolecularWeight: 430.45258

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=CC=CC=C2C=C1)OC(=O)CCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC(C(=O)NC1=CC2=CC=CC=C2C=C1)OC(=O)CCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C25H22N2O5/c1-16(23(29)26-19-13-12-17-7-2-3-8-18(17)15-19)32-22(28)11-6-14-27-24(30)20-9-4-5-10-21(20)25(27)31/h2-5,7-10,12-13,15-16H,6,11,14H2,1H3,(H,26,29)