3-methyl-N-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]-N-[(4-nitrophenyl)methyl]butan-1-amine

Systemtic Name: 3-methyl-N-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]-N-[(4-nitrophenyl)methyl]butan-1-amine Openeye Name: 3-methyl-N-[[1-(m-tolylmethyl)pyrrol-2-yl]methyl]-N-[(4-nitrophenyl)methyl]butan-1-amine CAS Name: 3-methyl-N-[[1-[(3-methylphenyl)methyl]-2-pyrrolyl]methyl]-N-[(4-nitrophenyl)methyl]-1-butanamine IUPAC Name: 3-methyl-N-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]-N-[(4-nitrophenyl)methyl]butan-1-amine Traditional Name: isoamyl-[[1-(3-methylbenzyl)pyrrol-2-yl]methyl]-(4-nitrobenzyl)amine Formula: C25H31N3O2 MolecularWeight: 405.53254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2C=CC=C2CN(CCC(C)C)CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)CN2C=CC=C2CN(CCC(C)C)CC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C25H31N3O2/c1-20(2)13-15-26(17-22-9-11-24(12-10-22)28(29)30)19-25-8-5-14-27(25)18-23-7-4-6-21(3)16-23/h4-12,14,16,20H,13,15,17-19H2,1-3H3