2-[4-[4,4-dimethyl-2,6-bis(oxidanylidene)cyclohexyl]-4-prop-2-enylimino-butyl]isoindole-1,3-dione

Systemtic Name: 2-[4-[4,4-dimethyl-2,6-bis(oxidanylidene)cyclohexyl]-4-prop-2-enylimino-butyl]isoindole-1,3-dione Openeye Name: 2-[4-allylimino-4-(4,4-dimethyl-2,6-dioxo-cyclohexyl)butyl]isoindoline-1,3-dione CAS Name: 2-[4-(4,4-dimethyl-2,6-dioxocyclohexyl)-4-prop-2-enyliminobutyl]isoindole-1,3-dione IUPAC Name: 2-[4-(4,4-dimethyl-2,6-dioxocyclohexyl)-4-prop-2-enyliminobutyl]isoindole-1,3-dione Traditional Name: 2-[4-allylimino-4-(2,6-diketo-4,4-dimethyl-cyclohexyl)butyl]isoindoline-1,3-quinone Formula: C23H26N2O4 MolecularWeight: 394.46354

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(C(=O)C1)C(=NCC=C)CCCN2C(=O)C3=CC=CC=C3C2=O)C

Isomeric SMILES

CC1(CC(=O)C(C(=O)C1)C(=NCC=C)CCCN2C(=O)C3=CC=CC=C3C2=O)C

InChI

InChI=1S/C23H26N2O4/c1-4-11-24-17(20-18(26)13-23(2,3)14-19(20)27)10-7-12-25-21(28)15-8-5-6-9-16(15)22(25)29/h4-6,8-9,20H,1,7,10-14H2,2-3H3