[2-[[4-(cyclohexa-1,3-dien-1-ylcarbonylamino)phenyl]methyl]-6-methoxy-3,4-dihydro-1H-isoquinolin-7-yl] carbamate

Systemtic Name: [2-[[4-(cyclohexa-1,3-dien-1-ylcarbonylamino)phenyl]methyl]-6-methoxy-3,4-dihydro-1H-isoquinolin-7-yl] carbamate Openeye Name: [2-[[4-(cyclohexa-1,3-diene-1-carbonylamino)phenyl]methyl]-6-methoxy-3,4-dihydro-1H-isoquinolin-7-yl] carbamate CAS Name: carbamic acid [2-[[4-[[1-cyclohexa-1,3-dienyl(oxo)methyl]amino]phenyl]methyl]-6-methoxy-3,4-dihydro-1H-isoquinolin-7-yl] ester IUPAC Name: [2-[[4-(cyclohexa-1,3-diene-1-carbonylamino)phenyl]methyl]-6-methoxy-3,4-dihydro-1H-isoquinolin-7-yl] carbamate Traditional Name: carbamic acid [2-[4-(cyclohexa-1,3-diene-1-carbonylamino)benzyl]-6-methoxy-3,4-dihydro-1H-isoquinolin-7-yl] ester Formula: C25H27N3O4 MolecularWeight: 433.49958

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)CC3=CC=C(C=C3)NC(=O)C4=CC=CCC4)OC(=O)N

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)CC3=CC=C(C=C3)NC(=O)C4=CC=CCC4)OC(=O)N

InChI

InChI=1S/C25H27N3O4/c1-31-22-13-19-11-12-28(16-20(19)14-23(22)32-25(26)30)15-17-7-9-21(10-8-17)27-24(29)18-5-3-2-4-6-18/h2-3,5,7-10,13-14H,4,6,11-12,15-16H2,1H3,(H2,26,30)(H,27,29)