N-[(1S)-1-(1H-benzimidazol-2-yl)-2-methyl-propyl]-2-nitro-aniline

Systemtic Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-methyl-propyl]-2-nitro-aniline Openeye Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-methyl-propyl]-2-nitro-aniline CAS Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-methylpropyl]-2-nitroaniline IUPAC Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-methylpropyl]-2-nitroaniline Traditional Name: [(1S)-1-(1H-benzimidazol-2-yl)-2-methyl-propyl]-(2-nitrophenyl)amine Formula: C17H18N4O2 MolecularWeight: 310.35042

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=NC2=CC=CC=C2N1)NC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC(C)[C@@H](C1=NC2=CC=CC=C2N1)NC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C17H18N4O2/c1-11(2)16(17-19-12-7-3-4-8-13(12)20-17)18-14-9-5-6-10-15(14)21(22)23/h3-11,16,18H,1-2H3,(H,19,20)/t16-/m0/s1