3-methyl-1-[1-phenyl-7-[[4-(4-prop-2-enylpiperazin-1-yl)carbonyl-1,3-oxazol-2-yl]methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]butan-1-one

Systemtic Name: 3-methyl-1-[1-phenyl-7-[[4-(4-prop-2-enylpiperazin-1-yl)carbonyl-1,3-oxazol-2-yl]methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]butan-1-one Openeye Name: 1-[7-[[4-(4-allylpiperazine-1-carbonyl)oxazol-2-yl]methoxy]-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]-3-methyl-butan-1-one CAS Name: 3-methyl-1-[7-[[4-[oxo-(4-prop-2-enyl-1-piperazinyl)methyl]-2-oxazolyl]methoxy]-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]-1-butanone IUPAC Name: 3-methyl-1-[1-phenyl-7-[[4-(4-prop-2-enylpiperazine-1-carbonyl)-1,3-oxazol-2-yl]methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]butan-1-one Traditional Name: 1-[7-[[4-(4-allylpiperazine-1-carbonyl)oxazol-2-yl]methoxy]-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]-3-methyl-butan-1-one Formula: C32H38N4O4 MolecularWeight: 542.66852

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N1CCC2=C(C1C3=CC=CC=C3)C=C(C=C2)OCC4=NC(=CO4)C(=O)N5CCN(CC5)CC=C

Isomeric SMILES

CC(C)CC(=O)N1CCC2=C(C1C3=CC=CC=C3)C=C(C=C2)OCC4=NC(=CO4)C(=O)N5CCN(CC5)CC=C

InChI

InChI=1S/C32H38N4O4/c1-4-13-34-15-17-35(18-16-34)32(38)28-21-40-29(33-28)22-39-26-11-10-24-12-14-36(30(37)19-23(2)3)31(27(24)20-26)25-8-6-5-7-9-25/h4-11,20-21,23,31H,1,12-19,22H2,2-3H3