(5S)-1-(3,4-dimethoxyphenyl)-5-ethyl-7-methoxy-4-methyl-5H-2,3-benzodiazepin-8-ol

Systemtic Name: (5S)-1-(3,4-dimethoxyphenyl)-5-ethyl-7-methoxy-4-methyl-5H-2,3-benzodiazepin-8-ol Openeye Name: (5S)-1-(3,4-dimethoxyphenyl)-5-ethyl-7-methoxy-4-methyl-5H-2,3-benzodiazepin-8-ol CAS Name: (5S)-1-(3,4-dimethoxyphenyl)-5-ethyl-7-methoxy-4-methyl-5H-2,3-benzodiazepin-8-ol IUPAC Name: (5S)-1-(3,4-dimethoxyphenyl)-5-ethyl-7-methoxy-4-methyl-5H-2,3-benzodiazepin-8-ol Traditional Name: (5S)-1-(3,4-dimethoxyphenyl)-5-ethyl-7-methoxy-4-methyl-5H-2,3-benzodiazepin-8-ol Formula: C21H24N2O4 MolecularWeight: 368.42626

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=NN=C(C2=CC(=C(C=C12)OC)O)C3=CC(=C(C=C3)OC)OC)C

Isomeric SMILES

CC[C@@H]1C(=NN=C(C2=CC(=C(C=C12)OC)O)C3=CC(=C(C=C3)OC)OC)C

InChI

InChI=1S/C21H24N2O4/c1-6-14-12(2)22-23-21(13-7-8-18(25-3)20(9-13)27-5)16-10-17(24)19(26-4)11-15(14)16/h7-11,14,24H,6H2,1-5H3/t14-/m1/s1