[4-[3-[(3-methyl-3-naphthalen-1-yloxy-2-oxidanyl-butan-2-yl)amino]propylamino]-4-oxidanylidene-butyl] nitrate

Systemtic Name: [4-[3-[(3-methyl-3-naphthalen-1-yloxy-2-oxidanyl-butan-2-yl)amino]propylamino]-4-oxidanylidene-butyl] nitrate Openeye Name: [4-[3-[[1-hydroxy-1,2-dimethyl-2-(1-naphthyloxy)propyl]amino]propylamino]-4-oxo-butyl] nitrate CAS Name: nitric acid [4-[3-[[2-hydroxy-3-methyl-3-(1-naphthalenyloxy)butan-2-yl]amino]propylamino]-4-oxobutyl] ester IUPAC Name: [4-[3-[(2-hydroxy-3-methyl-3-naphthalen-1-yloxybutan-2-yl)amino]propylamino]-4-oxobutyl] nitrate Traditional Name: nitric acid [4-[3-[[1-hydroxy-1,2-dimethyl-2-(1-naphthoxy)propyl]amino]propylamino]-4-keto-butyl] ester Formula: C22H31N3O6 MolecularWeight: 433.49804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(C)(NCCCNC(=O)CCCO[N+](=O)[O-])O)OC1=CC=CC2=CC=CC=C21

Isomeric SMILES

CC(C)(C(C)(NCCCNC(=O)CCCO[N+](=O)[O-])O)OC1=CC=CC2=CC=CC=C21

InChI

InChI=1S/C22H31N3O6/c1-21(2,31-19-12-6-10-17-9-4-5-11-18(17)19)22(3,27)24-15-8-14-23-20(26)13-7-16-30-25(28)29/h4-6,9-12,24,27H,7-8,13-16H2,1-3H3,(H,23,26)