2-[(4-chlorophenyl)methylamino]-7-methyl-5-(2-piperidin-4-ylethoxy)-3H-isoindol-1-one

Systemtic Name: 2-[(4-chlorophenyl)methylamino]-7-methyl-5-(2-piperidin-4-ylethoxy)-3H-isoindol-1-one Openeye Name: 2-[(4-chlorophenyl)methylamino]-7-methyl-5-[2-(4-piperidyl)ethoxy]isoindolin-1-one CAS Name: 2-[(4-chlorophenyl)methylamino]-7-methyl-5-[2-(4-piperidinyl)ethoxy]-3H-isoindol-1-one IUPAC Name: 2-[(4-chlorophenyl)methylamino]-7-methyl-5-(2-piperidin-4-ylethoxy)-3H-isoindol-1-one Traditional Name: 2-[(4-chlorobenzyl)amino]-7-methyl-5-[2-(4-piperidyl)ethoxy]isoindolin-1-one Formula: C23H28ClN3O2 MolecularWeight: 413.94032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)OCCC3CCNCC3)CN(C2=O)NCC4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=C2C(=CC(=C1)OCCC3CCNCC3)CN(C2=O)NCC4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H28ClN3O2/c1-16-12-21(29-11-8-17-6-9-25-10-7-17)13-19-15-27(23(28)22(16)19)26-14-18-2-4-20(24)5-3-18/h2-5,12-13,17,25-26H,6-11,14-15H2,1H3