(5S)-5-ethyl-8-methoxy-1-(4-methoxy-3-oxidanyl-phenyl)-4-methyl-2,5-dihydro-2,3-benzodiazepin-7-one

Systemtic Name: (5S)-5-ethyl-8-methoxy-1-(4-methoxy-3-oxidanyl-phenyl)-4-methyl-2,5-dihydro-2,3-benzodiazepin-7-one Openeye Name: (5S)-5-ethyl-1-(3-hydroxy-4-methoxy-phenyl)-8-methoxy-4-methyl-2,5-dihydro-2,3-benzodiazepin-7-one CAS Name: (5S)-5-ethyl-1-(3-hydroxy-4-methoxyphenyl)-8-methoxy-4-methyl-2,5-dihydro-2,3-benzodiazepin-7-one IUPAC Name: (5S)-5-ethyl-1-(3-hydroxy-4-methoxyphenyl)-8-methoxy-4-methyl-2,5-dihydro-2,3-benzodiazepin-7-one Traditional Name: (5S)-5-ethyl-1-(3-hydroxy-4-methoxy-phenyl)-8-methoxy-4-methyl-2,5-dihydro-2,3-benzodiazepin-7-one Formula: C20H22N2O4 MolecularWeight: 354.39968

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=NNC(=C2C1=CC(=O)C(=C2)OC)C3=CC(=C(C=C3)OC)O)C

Isomeric SMILES

CC[C@@H]1C(=NNC(=C2C1=CC(=O)C(=C2)OC)C3=CC(=C(C=C3)OC)O)C

InChI

InChI=1S/C20H22N2O4/c1-5-13-11(2)21-22-20(12-6-7-18(25-3)16(23)8-12)15-10-19(26-4)17(24)9-14(13)15/h6-10,13,22-23H,5H2,1-4H3/t13-/m1/s1