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8-nitro-3-(phenylmethyl)-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine

8-nitro-3-(phenylmethyl)-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine

Systemtic Name:8-nitro-3-(phenylmethyl)-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine
Openeye Name:3-benzyl-8-nitro-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine
CAS Name:8-nitro-3-(phenylmethyl)-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine
IUPAC Name:3-benzyl-8-nitro-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine
Traditional Name:3-benzyl-8-nitro-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine
Formula: C16H17N3O2
MolecularWeight: 283.32508
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Descriptors Computed from Structure

Canonical SMILES:

C1C(NCC2=C(N1)C=C(C=C2)[N+](=O)[O-])CC3=CC=CC=C3


Isomeric SMILES

C1C(NCC2=C(N1)C=C(C=C2)[N+](=O)[O-])CC3=CC=CC=C3


InChI

InChI=1S/C16H17N3O2/c20-19(21)15-7-6-13-10-17-14(11-18-16(13)9-15)8-12-4-2-1-3-5-12/h1-7,9,14,17-18H,8,10-11H2


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