9-chloranyl-2-(phenylmethyl)-4,5,5a,6-tetrahydro-3H-1,2-benzodiazepin-7-one

Systemtic Name: 9-chloranyl-2-(phenylmethyl)-4,5,5a,6-tetrahydro-3H-1,2-benzodiazepin-7-one Openeye Name: 2-benzyl-9-chloro-4,5,5a,6-tetrahydro-3H-1,2-benzodiazepin-7-one CAS Name: 9-chloro-2-(phenylmethyl)-4,5,5a,6-tetrahydro-3H-1,2-benzodiazepin-7-one IUPAC Name: 2-benzyl-9-chloro-4,5,5a,6-tetrahydro-3H-1,2-benzodiazepin-7-one Traditional Name: 2-benzyl-9-chloro-4,5,5a,6-tetrahydro-3H-1,2-benzodiazepin-7-one Formula: C16H17ClN2O MolecularWeight: 288.77198

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2CC(=O)C=C(C2=NN(C1)CC3=CC=CC=C3)Cl

Isomeric SMILES

C1CC2CC(=O)C=C(C2=NN(C1)CC3=CC=CC=C3)Cl

InChI

InChI=1S/C16H17ClN2O/c17-15-10-14(20)9-13-7-4-8-19(18-16(13)15)11-12-5-2-1-3-6-12/h1-3,5-6,10,13H,4,7-9,11H2