2-[2-(2-methylphenyl)-2-oxidanylidene-ethyl]-3H-isoindol-1-one; O1-methyl O4-piperidin-4-yl (E)-but-2-enedioate

Systemtic Name: 2-[2-(2-methylphenyl)-2-oxidanylidene-ethyl]-3H-isoindol-1-one; O1-methyl O4-piperidin-4-yl (E)-but-2-enedioate Openeye Name: O1-methyl O4-(4-piperidyl) (E)-but-2-enedioate; 2-[2-(o-tolyl)-2-oxo-ethyl]isoindolin-1-one CAS Name: (E)-2-butenedioic acid O1-methyl ester O4-(4-piperidinyl) ester; 2-[2-(2-methylphenyl)-2-oxoethyl]-3H-isoindol-1-one IUPAC Name: 2-[2-(2-methylphenyl)-2-oxoethyl]-3H-isoindol-1-one; 1-O-methyl 4-O-piperidin-4-yl (E)-but-2-enedioate Traditional Name: (E)-but-2-enedioic acid O1-methyl ester O4-(4-piperidyl) ester; 2-[2-keto-2-(o-tolyl)ethyl]isoindolin-1-one Formula: C27H30N2O6 MolecularWeight: 478.5369

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)CN2CC3=CC=CC=C3C2=O.COC(=O)C=CC(=O)OC1CCNCC1

Isomeric SMILES

CC1=CC=CC=C1C(=O)CN2CC3=CC=CC=C3C2=O.COC(=O)/C=C/C(=O)OC1CCNCC1

InChI

InChI=1S/C17H15NO2.C10H15NO4/c1-12-6-2-4-8-14(12)16(19)11-18-10-13-7-3-5-9-15(13)17(18)20;1-14-9(12)2-3-10(13)15-8-4-6-11-7-5-8/h2-9H,10-11H2,1H3;2-3,8,11H,4-7H2,1H3/b;3-2+