1-[4-[[(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)-methyl-amino]methyl]-4-phenyl-piperidin-1-yl]-3-oxidanyl-butan-1-one

Systemtic Name: 1-[4-[[(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)-methyl-amino]methyl]-4-phenyl-piperidin-1-yl]-3-oxidanyl-butan-1-one Openeye Name: 1-[4-[[(4-amino-6,7-dimethoxy-quinazolin-2-yl)-methyl-amino]methyl]-4-phenyl-1-piperidyl]-3-hydroxy-butan-1-one CAS Name: 1-[4-[[(4-amino-6,7-dimethoxy-2-quinazolinyl)-methylamino]methyl]-4-phenyl-1-piperidinyl]-3-hydroxy-1-butanone IUPAC Name: 1-[4-[[(4-amino-6,7-dimethoxyquinazolin-2-yl)-methylamino]methyl]-4-phenylpiperidin-1-yl]-3-hydroxybutan-1-one Traditional Name: 1-[4-[[(4-amino-6,7-dimethoxy-quinazolin-2-yl)-methyl-amino]methyl]-4-phenyl-piperidino]-3-hydroxy-butan-1-one Formula: C27H35N5O4 MolecularWeight: 493.5979

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)N1CCC(CC1)(CN(C)C2=NC3=CC(=C(C=C3C(=N2)N)OC)OC)C4=CC=CC=C4)O

Isomeric SMILES

CC(CC(=O)N1CCC(CC1)(CN(C)C2=NC3=CC(=C(C=C3C(=N2)N)OC)OC)C4=CC=CC=C4)O

InChI

InChI=1S/C27H35N5O4/c1-18(33)14-24(34)32-12-10-27(11-13-32,19-8-6-5-7-9-19)17-31(2)26-29-21-16-23(36-4)22(35-3)15-20(21)25(28)30-26/h5-9,15-16,18,33H,10-14,17H2,1-4H3,(H2,28,29,30)