N'-butyl-N-(3-methylphenyl)-N'-[(4-nitrophenyl)methyl]propane-1,3-diamine

Systemtic Name: N'-butyl-N-(3-methylphenyl)-N'-[(4-nitrophenyl)methyl]propane-1,3-diamine Openeye Name: N'-butyl-N-(m-tolyl)-N'-[(4-nitrophenyl)methyl]propane-1,3-diamine CAS Name: N'-butyl-N-(3-methylphenyl)-N'-[(4-nitrophenyl)methyl]propane-1,3-diamine IUPAC Name: N'-butyl-N-(3-methylphenyl)-N'-[(4-nitrophenyl)methyl]propane-1,3-diamine Traditional Name: butyl-[3-(m-toluidino)propyl]-(4-nitrobenzyl)amine Formula: C21H29N3O2 MolecularWeight: 355.47386

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCNC1=CC=CC(=C1)C)CC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCN(CCCNC1=CC=CC(=C1)C)CC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C21H29N3O2/c1-3-4-14-23(17-19-9-11-21(12-10-19)24(25)26)15-6-13-22-20-8-5-7-18(2)16-20/h5,7-12,16,22H,3-4,6,13-15,17H2,1-2H3