2-[2-(3-methoxyphenyl)ethyl]-4-(3-pyrrolidin-1-ylcarbonylpiperidin-1-yl)isoindole-1,3-dione

Systemtic Name: 2-[2-(3-methoxyphenyl)ethyl]-4-(3-pyrrolidin-1-ylcarbonylpiperidin-1-yl)isoindole-1,3-dione Openeye Name: 2-[2-(3-methoxyphenyl)ethyl]-4-[3-(pyrrolidine-1-carbonyl)-1-piperidyl]isoindoline-1,3-dione CAS Name: 2-[2-(3-methoxyphenyl)ethyl]-4-[3-[oxo(1-pyrrolidinyl)methyl]-1-piperidinyl]isoindole-1,3-dione IUPAC Name: 2-[2-(3-methoxyphenyl)ethyl]-4-[3-(pyrrolidine-1-carbonyl)piperidin-1-yl]isoindole-1,3-dione Traditional Name: 2-[2-(3-methoxyphenyl)ethyl]-4-[3-(pyrrolidine-1-carbonyl)piperidino]isoindoline-1,3-quinone Formula: C27H31N3O4 MolecularWeight: 461.55274

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CCN2C(=O)C3=C(C2=O)C(=CC=C3)N4CCCC(C4)C(=O)N5CCCC5

Isomeric SMILES

COC1=CC=CC(=C1)CCN2C(=O)C3=C(C2=O)C(=CC=C3)N4CCCC(C4)C(=O)N5CCCC5

InChI

InChI=1S/C27H31N3O4/c1-34-21-9-4-7-19(17-21)12-16-30-26(32)22-10-5-11-23(24(22)27(30)33)29-15-6-8-20(18-29)25(31)28-13-2-3-14-28/h4-5,7,9-11,17,20H,2-3,6,8,12-16,18H2,1H3