1-[1-phenyl-7-[[5-(4-prop-2-enylpiperazin-1-yl)carbonylfuran-2-yl]methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]propan-1-one

Systemtic Name: 1-[1-phenyl-7-[[5-(4-prop-2-enylpiperazin-1-yl)carbonylfuran-2-yl]methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]propan-1-one Openeye Name: 1-[7-[[5-(4-allylpiperazine-1-carbonyl)-2-furyl]methoxy]-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]propan-1-one CAS Name: 1-[7-[[5-[oxo-(4-prop-2-enyl-1-piperazinyl)methyl]-2-furanyl]methoxy]-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]-1-propanone IUPAC Name: 1-[1-phenyl-7-[[5-(4-prop-2-enylpiperazine-1-carbonyl)furan-2-yl]methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]propan-1-one Traditional Name: 1-[7-[[5-(4-allylpiperazine-1-carbonyl)-2-furyl]methoxy]-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]propan-1-one Formula: C31H35N3O4 MolecularWeight: 513.6273

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCC2=C(C1C3=CC=CC=C3)C=C(C=C2)OCC4=CC=C(O4)C(=O)N5CCN(CC5)CC=C

Isomeric SMILES

CCC(=O)N1CCC2=C(C1C3=CC=CC=C3)C=C(C=C2)OCC4=CC=C(O4)C(=O)N5CCN(CC5)CC=C

InChI

InChI=1S/C31H35N3O4/c1-3-15-32-17-19-33(20-18-32)31(36)28-13-12-26(38-28)22-37-25-11-10-23-14-16-34(29(35)4-2)30(27(23)21-25)24-8-6-5-7-9-24/h3,5-13,21,30H,1,4,14-20,22H2,2H3