7-chloranyl-5-methyl-3-[(Z)-3-methyl-5-oxidanyl-pent-3-en-1-ynyl]-4H-imidazo[1,5-a][1,4]benzodiazepin-6-one

Systemtic Name: 7-chloranyl-5-methyl-3-[(Z)-3-methyl-5-oxidanyl-pent-3-en-1-ynyl]-4H-imidazo[1,5-a][1,4]benzodiazepin-6-one Openeye Name: 7-chloro-3-[(Z)-5-hydroxy-3-methyl-pent-3-en-1-ynyl]-5-methyl-4H-imidazo[1,5-a][1,4]benzodiazepin-6-one CAS Name: 7-chloro-3-[(Z)-5-hydroxy-3-methylpent-3-en-1-ynyl]-5-methyl-4H-imidazo[1,5-a][1,4]benzodiazepin-6-one IUPAC Name: 7-chloro-3-[(Z)-5-hydroxy-3-methylpent-3-en-1-ynyl]-5-methyl-4H-imidazo[1,5-a][1,4]benzodiazepin-6-one Traditional Name: 7-chloro-3-[(Z)-5-hydroxy-3-methyl-pent-3-en-1-ynyl]-5-methyl-4H-imidazo[1,5-a][1,4]benzodiazepin-6-one Formula: C18H16ClN3O2 MolecularWeight: 341.79154

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCO)C#CC1=C2CN(C(=O)C3=C(N2C=N1)C=CC=C3Cl)C

Isomeric SMILES

C/C(=C/CO)/C#CC1=C2CN(C(=O)C3=C(N2C=N1)C=CC=C3Cl)C

InChI

InChI=1S/C18H16ClN3O2/c1-12(8-9-23)6-7-14-16-10-21(2)18(24)17-13(19)4-3-5-15(17)22(16)11-20-14/h3-5,8,11,23H,9-10H2,1-2H3/b12-8-