6-(1-ethanimidoylpiperidin-4-yl)oxy-2-phenethyl-3,4-dihydroisoquinolin-1-one

Systemtic Name: 6-(1-ethanimidoylpiperidin-4-yl)oxy-2-phenethyl-3,4-dihydroisoquinolin-1-one Openeye Name: 6-[(1-ethanimidoyl-4-piperidyl)oxy]-2-phenethyl-3,4-dihydroisoquinolin-1-one CAS Name: 6-[[1-(1-iminoethyl)-4-piperidinyl]oxy]-2-phenethyl-3,4-dihydroisoquinolin-1-one IUPAC Name: 6-(1-ethanimidoylpiperidin-4-yl)oxy-2-phenethyl-3,4-dihydroisoquinolin-1-one Traditional Name: 6-[(1-acetimidoyl-4-piperidyl)oxy]-2-phenethyl-3,4-dihydroisocarbostyril Formula: C24H29N3O2 MolecularWeight: 391.50596

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)N1CCC(CC1)OC2=CC3=C(C=C2)C(=O)N(CC3)CCC4=CC=CC=C4

Isomeric SMILES

CC(=N)N1CCC(CC1)OC2=CC3=C(C=C2)C(=O)N(CC3)CCC4=CC=CC=C4

InChI

InChI=1S/C24H29N3O2/c1-18(25)26-15-11-21(12-16-26)29-22-7-8-23-20(17-22)10-14-27(24(23)28)13-9-19-5-3-2-4-6-19/h2-8,17,21,25H,9-16H2,1H3