N-[(4-nitrophenyl)methyl]-5-phenyl-4,5-dihydro-1H-1,3-benzodiazepin-2-amine

Systemtic Name: N-[(4-nitrophenyl)methyl]-5-phenyl-4,5-dihydro-1H-1,3-benzodiazepin-2-amine Openeye Name: N-[(4-nitrophenyl)methyl]-5-phenyl-4,5-dihydro-1H-1,3-benzodiazepin-2-amine CAS Name: N-[(4-nitrophenyl)methyl]-5-phenyl-4,5-dihydro-1H-1,3-benzodiazepin-2-amine IUPAC Name: N-[(4-nitrophenyl)methyl]-5-phenyl-4,5-dihydro-1H-1,3-benzodiazepin-2-amine Traditional Name: (4-nitrobenzyl)-(5-phenyl-4,5-dihydro-1H-1,3-benzodiazepin-2-yl)amine Formula: C22H20N4O2 MolecularWeight: 372.4198

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C2=CC=CC=C2NC(=N1)NCC3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

C1C(C2=CC=CC=C2NC(=N1)NCC3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C22H20N4O2/c27-26(28)18-12-10-16(11-13-18)14-23-22-24-15-20(17-6-2-1-3-7-17)19-8-4-5-9-21(19)25-22/h1-13,20H,14-15H2,(H2,23,24,25)