2-[(2-ethanoyl-1-phenyl-3,4-dihydro-1H-isoquinolin-7-yl)oxy]-1-(4-methylpiperazin-1-yl)butan-1-one

Systemtic Name: 2-[(2-ethanoyl-1-phenyl-3,4-dihydro-1H-isoquinolin-7-yl)oxy]-1-(4-methylpiperazin-1-yl)butan-1-one Openeye Name: 2-[(2-acetyl-1-phenyl-3,4-dihydro-1H-isoquinolin-7-yl)oxy]-1-(4-methylpiperazin-1-yl)butan-1-one CAS Name: 2-[(2-acetyl-1-phenyl-3,4-dihydro-1H-isoquinolin-7-yl)oxy]-1-(4-methyl-1-piperazinyl)-1-butanone IUPAC Name: 2-[(2-acetyl-1-phenyl-3,4-dihydro-1H-isoquinolin-7-yl)oxy]-1-(4-methylpiperazin-1-yl)butan-1-one Traditional Name: 2-[(2-acetyl-1-phenyl-3,4-dihydro-1H-isoquinolin-7-yl)oxy]-1-(4-methylpiperazino)butan-1-one Formula: C26H33N3O3 MolecularWeight: 435.55852

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N1CCN(CC1)C)OC2=CC3=C(CCN(C3C4=CC=CC=C4)C(=O)C)C=C2

Isomeric SMILES

CCC(C(=O)N1CCN(CC1)C)OC2=CC3=C(CCN(C3C4=CC=CC=C4)C(=O)C)C=C2

InChI

InChI=1S/C26H33N3O3/c1-4-24(26(31)28-16-14-27(3)15-17-28)32-22-11-10-20-12-13-29(19(2)30)25(23(20)18-22)21-8-6-5-7-9-21/h5-11,18,24-25H,4,12-17H2,1-3H3