1-chloranyl-6-ethoxy-5-methyl-8-oxidanyl-10,12-dihydropyrimido[4,5-b][1,4]benzodiazocin-11-one

Systemtic Name: 1-chloranyl-6-ethoxy-5-methyl-8-oxidanyl-10,12-dihydropyrimido[4,5-b][1,4]benzodiazocin-11-one Openeye Name: 1-chloro-6-ethoxy-8-hydroxy-5-methyl-10,12-dihydropyrimido[4,5-b][1,4]benzodiazocin-11-one CAS Name: 1-chloro-6-ethoxy-8-hydroxy-5-methyl-10,12-dihydropyrimido[4,5-b][1,4]benzodiazocin-11-one IUPAC Name: 1-chloro-6-ethoxy-8-hydroxy-5-methyl-10,12-dihydropyrimido[4,5-b][1,4]benzodiazocin-11-one Traditional Name: 1-chloro-6-ethoxy-8-hydroxy-5-methyl-10,12-dihydropyrimido[4,5-b][1,4]benzodiazocin-11-one Formula: C15H15ClN4O3 MolecularWeight: 334.7576

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C2C(=CC(=C1)O)CC(=O)NC3=C(N2C)N=CN=C3Cl

Isomeric SMILES

CCOC1=C2C(=CC(=C1)O)CC(=O)NC3=C(N2C)N=CN=C3Cl

InChI

InChI=1S/C15H15ClN4O3/c1-3-23-10-6-9(21)4-8-5-11(22)19-12-14(16)17-7-18-15(12)20(2)13(8)10/h4,6-7,21H,3,5H2,1-2H3,(H,19,22)