N-[(3-chlorophenyl)methyl]-4-nitro-3-piperazin-1-yl-aniline

Systemtic Name: N-[(3-chlorophenyl)methyl]-4-nitro-3-piperazin-1-yl-aniline Openeye Name: N-[(3-chlorophenyl)methyl]-4-nitro-3-piperazin-1-yl-aniline CAS Name: N-[(3-chlorophenyl)methyl]-4-nitro-3-(1-piperazinyl)aniline IUPAC Name: N-[(3-chlorophenyl)methyl]-4-nitro-3-piperazin-1-ylaniline Traditional Name: (3-chlorobenzyl)-(4-nitro-3-piperazino-phenyl)amine Formula: C17H19ClN4O2 MolecularWeight: 346.81136

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=C(C=CC(=C2)NCC3=CC(=CC=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1)C2=C(C=CC(=C2)NCC3=CC(=CC=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H19ClN4O2/c18-14-3-1-2-13(10-14)12-20-15-4-5-16(22(23)24)17(11-15)21-8-6-19-7-9-21/h1-5,10-11,19-20H,6-9,12H2