2-[5-[[4-(hydroxymethyl)piperidin-1-yl]methyl]-3,4-dihydro-1H-isoquinolin-2-yl]-6,7-dimethoxy-1H-quinazolin-4-one

Systemtic Name: 2-[5-[[4-(hydroxymethyl)piperidin-1-yl]methyl]-3,4-dihydro-1H-isoquinolin-2-yl]-6,7-dimethoxy-1H-quinazolin-4-one Openeye Name: 2-[5-[[4-(hydroxymethyl)-1-piperidyl]methyl]-3,4-dihydro-1H-isoquinolin-2-yl]-6,7-dimethoxy-1H-quinazolin-4-one CAS Name: 2-[5-[[4-(hydroxymethyl)-1-piperidinyl]methyl]-3,4-dihydro-1H-isoquinolin-2-yl]-6,7-dimethoxy-1H-quinazolin-4-one IUPAC Name: 2-[5-[[4-(hydroxymethyl)piperidin-1-yl]methyl]-3,4-dihydro-1H-isoquinolin-2-yl]-6,7-dimethoxy-1H-quinazolin-4-one Traditional Name: 6,7-dimethoxy-2-[5-[(4-methylolpiperidino)methyl]-3,4-dihydro-1H-isoquinolin-2-yl]-1H-quinazolin-4-one Formula: C26H32N4O4 MolecularWeight: 464.55668

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=O)N=C(N2)N3CCC4=C(C3)C=CC=C4CN5CCC(CC5)CO)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=O)N=C(N2)N3CCC4=C(C3)C=CC=C4CN5CCC(CC5)CO)OC

InChI

InChI=1S/C26H32N4O4/c1-33-23-12-21-22(13-24(23)34-2)27-26(28-25(21)32)30-11-8-20-18(4-3-5-19(20)15-30)14-29-9-6-17(16-31)7-10-29/h3-5,12-13,17,31H,6-11,14-16H2,1-2H3,(H,27,28,32)