1-[(4-nitrophenyl)methyl]-4-(phenylmethyl)-1,4-diazepane

Systemtic Name: 1-[(4-nitrophenyl)methyl]-4-(phenylmethyl)-1,4-diazepane Openeye Name: 1-benzyl-4-[(4-nitrophenyl)methyl]-1,4-diazepane CAS Name: 1-[(4-nitrophenyl)methyl]-4-(phenylmethyl)-1,4-diazepane IUPAC Name: 1-benzyl-4-[(4-nitrophenyl)methyl]-1,4-diazepane Traditional Name: 1-benzyl-4-(4-nitrobenzyl)-1,4-diazepane Formula: C19H23N3O2 MolecularWeight: 325.40482

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)CC2=CC=C(C=C2)[N+](=O)[O-])CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN(C1)CC2=CC=C(C=C2)[N+](=O)[O-])CC3=CC=CC=C3

InChI

InChI=1S/C19H23N3O2/c23-22(24)19-9-7-18(8-10-19)16-21-12-4-11-20(13-14-21)15-17-5-2-1-3-6-17/h1-3,5-10H,4,11-16H2