7-chloranyl-5-methyl-3-[(E)-3-oxidanylbut-1-enyl]-4H-imidazo[1,5-a][1,4]benzodiazepin-6-one

Systemtic Name: 7-chloranyl-5-methyl-3-[(E)-3-oxidanylbut-1-enyl]-4H-imidazo[1,5-a][1,4]benzodiazepin-6-one Openeye Name: 7-chloro-3-[(E)-3-hydroxybut-1-enyl]-5-methyl-4H-imidazo[1,5-a][1,4]benzodiazepin-6-one CAS Name: 7-chloro-3-[(E)-3-hydroxybut-1-enyl]-5-methyl-4H-imidazo[1,5-a][1,4]benzodiazepin-6-one IUPAC Name: 7-chloro-3-[(E)-3-hydroxybut-1-enyl]-5-methyl-4H-imidazo[1,5-a][1,4]benzodiazepin-6-one Traditional Name: 7-chloro-3-[(E)-3-hydroxybut-1-enyl]-5-methyl-4H-imidazo[1,5-a][1,4]benzodiazepin-6-one Formula: C16H16ClN3O2 MolecularWeight: 317.77014

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(/C=C/C1=C2CN(C(=O)C3=C(N2C=N1)C=CC=C3Cl)C)O

InChI

InChI=1S/C16H16ClN3O2/c1-10(21)6-7-12-14-8-19(2)16(22)15-11(17)4-3-5-13(15)20(14)9-18-12/h3-7,9-10,21H,8H2,1-2H3/b7-6+