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

Systemtic Name: 2-[5-[[2-(hydroxymethyl)pyrrolidin-1-yl]methyl]-3,4-dihydro-1H-isoquinolin-2-yl]-6,7-dimethoxy-1H-quinazolin-4-one Openeye Name: 2-[5-[[2-(hydroxymethyl)pyrrolidin-1-yl]methyl]-3,4-dihydro-1H-isoquinolin-2-yl]-6,7-dimethoxy-1H-quinazolin-4-one CAS Name: 2-[5-[[2-(hydroxymethyl)-1-pyrrolidinyl]methyl]-3,4-dihydro-1H-isoquinolin-2-yl]-6,7-dimethoxy-1H-quinazolin-4-one IUPAC Name: 2-[5-[[2-(hydroxymethyl)pyrrolidin-1-yl]methyl]-3,4-dihydro-1H-isoquinolin-2-yl]-6,7-dimethoxy-1H-quinazolin-4-one Traditional Name: 6,7-dimethoxy-2-[5-[(2-methylolpyrrolidino)methyl]-3,4-dihydro-1H-isoquinolin-2-yl]-1H-quinazolin-4-one Formula: C25H30N4O4 MolecularWeight: 450.5301

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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=C4CN5CCCC5CO)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=O)N=C(N2)N3CCC4=C(C3)C=CC=C4CN5CCCC5CO)OC

InChI

InChI=1S/C25H30N4O4/c1-32-22-11-20-21(12-23(22)33-2)26-25(27-24(20)31)29-10-8-19-16(5-3-6-17(19)14-29)13-28-9-4-7-18(28)15-30/h3,5-6,11-12,18,30H,4,7-10,13-15H2,1-2H3,(H,26,27,31)