2-[[bis(phenylmethyl)amino]methyl]-4-bromanyl-3-methyl-6-nitro-aniline

Systemtic Name: 2-[[bis(phenylmethyl)amino]methyl]-4-bromanyl-3-methyl-6-nitro-aniline Openeye Name: 4-bromo-2-[(dibenzylamino)methyl]-3-methyl-6-nitro-aniline CAS Name: 2-[[bis(phenylmethyl)amino]methyl]-4-bromo-3-methyl-6-nitroaniline IUPAC Name: 4-bromo-2-[(dibenzylamino)methyl]-3-methyl-6-nitroaniline Traditional Name: (2-amino-5-bromo-6-methyl-3-nitro-benzyl)-dibenzyl-amine Formula: C22H22BrN3O2 MolecularWeight: 440.33298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1CN(CC2=CC=CC=C2)CC3=CC=CC=C3)N)[N+](=O)[O-])Br

Isomeric SMILES

CC1=C(C=C(C(=C1CN(CC2=CC=CC=C2)CC3=CC=CC=C3)N)[N+](=O)[O-])Br

InChI

InChI=1S/C22H22BrN3O2/c1-16-19(22(24)21(26(27)28)12-20(16)23)15-25(13-17-8-4-2-5-9-17)14-18-10-6-3-7-11-18/h2-12H,13-15,24H2,1H3