N-methyl-2-[(E)-2-(1-methyl-2,3-dihydro-1,4-benzodiazepin-5-yl)ethenyl]-4-nitro-N-(phenylmethyl)aniline

Systemtic Name: N-methyl-2-[(E)-2-(1-methyl-2,3-dihydro-1,4-benzodiazepin-5-yl)ethenyl]-4-nitro-N-(phenylmethyl)aniline Openeye Name: N-benzyl-N-methyl-2-[(E)-2-(1-methyl-2,3-dihydro-1,4-benzodiazepin-5-yl)vinyl]-4-nitro-aniline CAS Name: N-methyl-2-[(E)-2-(1-methyl-2,3-dihydro-1,4-benzodiazepin-5-yl)ethenyl]-4-nitro-N-(phenylmethyl)aniline IUPAC Name: N-benzyl-N-methyl-2-[(E)-2-(1-methyl-2,3-dihydro-1,4-benzodiazepin-5-yl)ethenyl]-4-nitroaniline Traditional Name: benzyl-methyl-[2-[(E)-2-(1-methyl-2,3-dihydro-1,4-benzodiazepin-5-yl)vinyl]-4-nitro-phenyl]amine Formula: C26H26N4O2 MolecularWeight: 426.51024

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN=C(C2=CC=CC=C21)C=CC3=C(C=CC(=C3)[N+](=O)[O-])N(C)CC4=CC=CC=C4

Isomeric SMILES

CN1CCN=C(C2=CC=CC=C21)/C=C/C3=C(C=CC(=C3)[N+](=O)[O-])N(C)CC4=CC=CC=C4

InChI

InChI=1S/C26H26N4O2/c1-28-17-16-27-24(23-10-6-7-11-26(23)28)14-12-21-18-22(30(31)32)13-15-25(21)29(2)19-20-8-4-3-5-9-20/h3-15,18H,16-17,19H2,1-2H3/b14-12+