4-(3-methoxy-2-oxidanyl-phenyl)-2-methyl-4,5-dihydro-3H-naphtho[3,2-g][1,5]benzodiazepine-8,13-dione

Systemtic Name: 4-(3-methoxy-2-oxidanyl-phenyl)-2-methyl-4,5-dihydro-3H-naphtho[3,2-g][1,5]benzodiazepine-8,13-dione Openeye Name: 4-(2-hydroxy-3-methoxy-phenyl)-2-methyl-4,5-dihydro-3H-naphtho[3,2-g][1,5]benzodiazepine-8,13-dione CAS Name: 4-(2-hydroxy-3-methoxyphenyl)-2-methyl-4,5-dihydro-3H-naphtho[3,2-g][1,5]benzodiazepine-8,13-dione IUPAC Name: 4-(2-hydroxy-3-methoxyphenyl)-2-methyl-4,5-dihydro-3H-naphtho[3,2-g][1,5]benzodiazepine-8,13-dione Traditional Name: 4-(2-hydroxy-3-methoxy-phenyl)-2-methyl-4,5-dihydro-3H-naphtho[3,2-g][1,5]benzodiazepine-8,13-quinone Formula: C25H20N2O4 MolecularWeight: 412.4373

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC3=C2C(=O)C4=CC=CC=C4C3=O)NC(C1)C5=C(C(=CC=C5)OC)O

Isomeric SMILES

CC1=NC2=C(C=CC3=C2C(=O)C4=CC=CC=C4C3=O)NC(C1)C5=C(C(=CC=C5)OC)O

InChI

InChI=1S/C25H20N2O4/c1-13-12-19(16-8-5-9-20(31-2)24(16)29)27-18-11-10-17-21(22(18)26-13)25(30)15-7-4-3-6-14(15)23(17)28/h3-11,19,27,29H,12H2,1-2H3