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]ethanone

Systemtic Name: 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]ethanone Openeye Name: 1-[7-[[4-(4-allylpiperazine-1-carbonyl)oxazol-2-yl]methoxy]-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]ethanone CAS Name: 1-[7-[[4-[oxo-(4-prop-2-enyl-1-piperazinyl)methyl]-2-oxazolyl]methoxy]-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]ethanone IUPAC Name: 1-[1-phenyl-7-[[4-(4-prop-2-enylpiperazine-1-carbonyl)-1,3-oxazol-2-yl]methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]ethanone Traditional Name: 1-[7-[[4-(4-allylpiperazine-1-carbonyl)oxazol-2-yl]methoxy]-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]ethanone Formula: C29H32N4O4 MolecularWeight: 500.58878

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H32N4O4/c1-3-12-31-14-16-32(17-15-31)29(35)26-19-37-27(30-26)20-36-24-10-9-22-11-13-33(21(2)34)28(25(22)18-24)23-7-5-4-6-8-23/h3-10,18-19,28H,1,11-17,20H2,2H3