3-[1-(2-chloranyl-6,7-diethoxy-quinazolin-4-yl)piperidin-4-yl]-6-ethanoyl-1-methyl-quinazoline-2,4-dione

Systemtic Name: 3-[1-(2-chloranyl-6,7-diethoxy-quinazolin-4-yl)piperidin-4-yl]-6-ethanoyl-1-methyl-quinazoline-2,4-dione Openeye Name: 6-acetyl-3-[1-(2-chloro-6,7-diethoxy-quinazolin-4-yl)-4-piperidyl]-1-methyl-quinazoline-2,4-dione CAS Name: 6-acetyl-3-[1-(2-chloro-6,7-diethoxy-4-quinazolinyl)-4-piperidinyl]-1-methylquinazoline-2,4-dione IUPAC Name: 6-acetyl-3-[1-(2-chloro-6,7-diethoxyquinazolin-4-yl)piperidin-4-yl]-1-methylquinazoline-2,4-dione Traditional Name: 6-acetyl-3-[1-(2-chloro-6,7-diethoxy-quinazolin-4-yl)-4-piperidyl]-1-methyl-quinazoline-2,4-quinone Formula: C28H30ClN5O5 MolecularWeight: 552.0213

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)C(=NC(=N2)Cl)N3CCC(CC3)N4C(=O)C5=C(C=CC(=C5)C(=O)C)N(C4=O)C)OCC

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C(=NC(=N2)Cl)N3CCC(CC3)N4C(=O)C5=C(C=CC(=C5)C(=O)C)N(C4=O)C)OCC

InChI

InChI=1S/C28H30ClN5O5/c1-5-38-23-14-19-21(15-24(23)39-6-2)30-27(29)31-25(19)33-11-9-18(10-12-33)34-26(36)20-13-17(16(3)35)7-8-22(20)32(4)28(34)37/h7-8,13-15,18H,5-6,9-12H2,1-4H3