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

Systemtic Name: 2-[2-(3,4-dihydro-2H-quinolin-1-yl)ethyl]-3H-isoindol-1-one; O1-methyl O4-piperidin-4-yl (E)-but-2-enedioate Openeye Name: 2-[2-(3,4-dihydro-2H-quinolin-1-yl)ethyl]isoindolin-1-one; O1-methyl O4-(4-piperidyl) (E)-but-2-enedioate CAS Name: (E)-2-butenedioic acid O1-methyl ester O4-(4-piperidinyl) ester; 2-[2-(3,4-dihydro-2H-quinolin-1-yl)ethyl]-3H-isoindol-1-one IUPAC Name: 2-[2-(3,4-dihydro-2H-quinolin-1-yl)ethyl]-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-(3,4-dihydro-2H-quinolin-1-yl)ethyl]isoindolin-1-one Formula: C29H35N3O5 MolecularWeight: 505.6053

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=CC(=O)OC1CCNCC1.C1CC2=CC=CC=C2N(C1)CCN3CC4=CC=CC=C4C3=O

Isomeric SMILES

COC(=O)/C=C/C(=O)OC1CCNCC1.C1CC2=CC=CC=C2N(C1)CCN3CC4=CC=CC=C4C3=O

InChI

InChI=1S/C19H20N2O.C10H15NO4/c22-19-17-9-3-1-7-16(17)14-21(19)13-12-20-11-5-8-15-6-2-4-10-18(15)20;1-14-9(12)2-3-10(13)15-8-4-6-11-7-5-8/h1-4,6-7,9-10H,5,8,11-14H2;2-3,8,11H,4-7H2,1H3/b;3-2+