8-chloranyl-1-[4-(3-methylphenoxy)cyclohexyl]-5,6-dihydro-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine

Systemtic Name: 8-chloranyl-1-[4-(3-methylphenoxy)cyclohexyl]-5,6-dihydro-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine Openeye Name: 8-chloro-1-[4-(3-methylphenoxy)cyclohexyl]-5,6-dihydro-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine CAS Name: 8-chloro-1-[4-(3-methylphenoxy)cyclohexyl]-5,6-dihydro-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine IUPAC Name: 8-chloro-1-[4-(3-methylphenoxy)cyclohexyl]-5,6-dihydro-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine Traditional Name: 8-chloro-1-[4-(3-methylphenoxy)cyclohexyl]-5,6-dihydro-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine Formula: C23H25ClN4O MolecularWeight: 408.9238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC2CCC(CC2)C3=NN=C4N3C5=C(CNC4)C=C(C=C5)Cl

Isomeric SMILES

CC1=CC(=CC=C1)OC2CCC(CC2)C3=NN=C4N3C5=C(CNC4)C=C(C=C5)Cl

InChI

InChI=1S/C23H25ClN4O/c1-15-3-2-4-20(11-15)29-19-8-5-16(6-9-19)23-27-26-22-14-25-13-17-12-18(24)7-10-21(17)28(22)23/h2-4,7,10-12,16,19,25H,5-6,8-9,13-14H2,1H3