10-(3-bromanylpropanoyl)-1,3-dimethyl-5H-pyrrolo[2,3-c][1,5]benzodiazepin-4-one

Systemtic Name: 10-(3-bromanylpropanoyl)-1,3-dimethyl-5H-pyrrolo[2,3-c][1,5]benzodiazepin-4-one Openeye Name: 10-(3-bromopropanoyl)-1,3-dimethyl-5H-pyrrolo[2,3-c][1,5]benzodiazepin-4-one CAS Name: 10-(3-bromo-1-oxopropyl)-1,3-dimethyl-5H-pyrrolo[2,3-c][1,5]benzodiazepin-4-one IUPAC Name: 10-(3-bromopropanoyl)-1,3-dimethyl-5H-pyrrolo[2,3-c][1,5]benzodiazepin-4-one Traditional Name: 10-(3-bromopropanoyl)-1,3-dimethyl-5H-pyrrolo[2,3-c][1,5]benzodiazepin-4-one Formula: C16H16BrN3O2 MolecularWeight: 362.22114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C2=C1N(C3=CC=CC=C3NC2=O)C(=O)CCBr)C

Isomeric SMILES

CC1=CN(C2=C1N(C3=CC=CC=C3NC2=O)C(=O)CCBr)C

InChI

InChI=1S/C16H16BrN3O2/c1-10-9-19(2)15-14(10)20(13(21)7-8-17)12-6-4-3-5-11(12)18-16(15)22/h3-6,9H,7-8H2,1-2H3,(H,18,22)