(4S)-4-methyl-7-nitro-1-(phenylmethyl)-4,5-dihydro-3H-1,5-benzodiazepin-2-one

Systemtic Name: (4S)-4-methyl-7-nitro-1-(phenylmethyl)-4,5-dihydro-3H-1,5-benzodiazepin-2-one Openeye Name: (4S)-1-benzyl-4-methyl-7-nitro-4,5-dihydro-3H-1,5-benzodiazepin-2-one CAS Name: (4S)-4-methyl-7-nitro-1-(phenylmethyl)-4,5-dihydro-3H-1,5-benzodiazepin-2-one IUPAC Name: (4S)-1-benzyl-4-methyl-7-nitro-4,5-dihydro-3H-1,5-benzodiazepin-2-one Traditional Name: (4S)-1-benzyl-4-methyl-7-nitro-4,5-dihydro-3H-1,5-benzodiazepin-2-one Formula: C17H17N3O3 MolecularWeight: 311.33518

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)N(C2=C(N1)C=C(C=C2)[N+](=O)[O-])CC3=CC=CC=C3

Isomeric SMILES

C[C@H]1CC(=O)N(C2=C(N1)C=C(C=C2)[N+](=O)[O-])CC3=CC=CC=C3

InChI

InChI=1S/C17H17N3O3/c1-12-9-17(21)19(11-13-5-3-2-4-6-13)16-8-7-14(20(22)23)10-15(16)18-12/h2-8,10,12,18H,9,11H2,1H3/t12-/m0/s1