4-(4-chlorophenyl)-4-[(6,7,8-trimethoxyquinazolin-2-yl)amino]butan-1-ol

Systemtic Name: 4-(4-chlorophenyl)-4-[(6,7,8-trimethoxyquinazolin-2-yl)amino]butan-1-ol Openeye Name: 4-(4-chlorophenyl)-4-[(6,7,8-trimethoxyquinazolin-2-yl)amino]butan-1-ol CAS Name: 4-(4-chlorophenyl)-4-[(6,7,8-trimethoxy-2-quinazolinyl)amino]-1-butanol IUPAC Name: 4-(4-chlorophenyl)-4-[(6,7,8-trimethoxyquinazolin-2-yl)amino]butan-1-ol Traditional Name: 4-(4-chlorophenyl)-4-[(6,7,8-trimethoxyquinazolin-2-yl)amino]butan-1-ol Formula: C21H24ClN3O4 MolecularWeight: 417.88596

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C2C(=C1)C=NC(=N2)NC(CCCO)C3=CC=C(C=C3)Cl)OC)OC

Isomeric SMILES

COC1=C(C(=C2C(=C1)C=NC(=N2)NC(CCCO)C3=CC=C(C=C3)Cl)OC)OC

InChI

InChI=1S/C21H24ClN3O4/c1-27-17-11-14-12-23-21(25-18(14)20(29-3)19(17)28-2)24-16(5-4-10-26)13-6-8-15(22)9-7-13/h6-9,11-12,16,26H,4-5,10H2,1-3H3,(H,23,24,25)