[8-chloranyl-6-(3,4-dimethylphenyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-1-yl]methanol

Systemtic Name: [8-chloranyl-6-(3,4-dimethylphenyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-1-yl]methanol Openeye Name: [8-chloro-6-(3,4-dimethylphenyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-1-yl]methanol CAS Name: [8-chloro-6-(3,4-dimethylphenyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-1-yl]methanol IUPAC Name: [8-chloro-6-(3,4-dimethylphenyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-1-yl]methanol Traditional Name: [8-chloro-6-(3,4-dimethylphenyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-1-yl]methanol Formula: C19H17ClN4O MolecularWeight: 352.81748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NCC3=NN=C(N3C4=C2C=C(C=C4)Cl)CO)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NCC3=NN=C(N3C4=C2C=C(C=C4)Cl)CO)C

InChI

InChI=1S/C19H17ClN4O/c1-11-3-4-13(7-12(11)2)19-15-8-14(20)5-6-16(15)24-17(9-21-19)22-23-18(24)10-25/h3-8,25H,9-10H2,1-2H3