6-[(E)-4-(3,5-dimethyl-4-nitro-phenyl)but-3-enoxy]-N,N-bis(phenylmethyl)hexan-1-amine

Systemtic Name: 6-[(E)-4-(3,5-dimethyl-4-nitro-phenyl)but-3-enoxy]-N,N-bis(phenylmethyl)hexan-1-amine Openeye Name: N,N-dibenzyl-6-[(E)-4-(3,5-dimethyl-4-nitro-phenyl)but-3-enoxy]hexan-1-amine CAS Name: 6-[(E)-4-(3,5-dimethyl-4-nitrophenyl)but-3-enoxy]-N,N-bis(phenylmethyl)-1-hexanamine IUPAC Name: N,N-dibenzyl-6-[(E)-4-(3,5-dimethyl-4-nitrophenyl)but-3-enoxy]hexan-1-amine Traditional Name: dibenzyl-[6-[(E)-4-(3,5-dimethyl-4-nitro-phenyl)but-3-enoxy]hexyl]amine Formula: C32H40N2O3 MolecularWeight: 500.6716

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1[N+](=O)[O-])C)C=CCCOCCCCCCN(CC2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=CC(=C1[N+](=O)[O-])C)/C=C/CCOCCCCCCN(CC2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C32H40N2O3/c1-27-23-31(24-28(2)32(27)34(35)36)19-11-14-22-37-21-13-4-3-12-20-33(25-29-15-7-5-8-16-29)26-30-17-9-6-10-18-30/h5-11,15-19,23-24H,3-4,12-14,20-22,25-26H2,1-2H3/b19-11+