[1-(tert-butylamino)-3-[4-(cyclohexylcarbamoylamino)phenoxy]propan-2-yl] nitrate

Systemtic Name: [1-(tert-butylamino)-3-[4-(cyclohexylcarbamoylamino)phenoxy]propan-2-yl] nitrate Openeye Name: [1-[(tert-butylamino)methyl]-2-[4-(cyclohexylcarbamoylamino)phenoxy]ethyl] nitrate CAS Name: nitric acid [1-(tert-butylamino)-3-[4-[[(cyclohexylamino)-oxomethyl]amino]phenoxy]propan-2-yl] ester IUPAC Name: [1-(tert-butylamino)-3-[4-(cyclohexylcarbamoylamino)phenoxy]propan-2-yl] nitrate Traditional Name: nitric acid [1-[(tert-butylamino)methyl]-2-[4-(cyclohexylcarbamoylamino)phenoxy]ethyl] ester Formula: C20H32N4O5 MolecularWeight: 408.49188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NCC(COC1=CC=C(C=C1)NC(=O)NC2CCCCC2)O[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)NCC(COC1=CC=C(C=C1)NC(=O)NC2CCCCC2)O[N+](=O)[O-]

InChI

InChI=1S/C20H32N4O5/c1-20(2,3)21-13-18(29-24(26)27)14-28-17-11-9-16(10-12-17)23-19(25)22-15-7-5-4-6-8-15/h9-12,15,18,21H,4-8,13-14H2,1-3H3,(H2,22,23,25)