phenyl N-[3-(4-methylpiperazin-1-yl)octadecyl]-N-(3-oxidanylidenepropyl)carbamate

Systemtic Name: phenyl N-[3-(4-methylpiperazin-1-yl)octadecyl]-N-(3-oxidanylidenepropyl)carbamate Openeye Name: phenyl N-[3-(4-methylpiperazin-1-yl)octadecyl]-N-(3-oxopropyl)carbamate CAS Name: N-[3-(4-methyl-1-piperazinyl)octadecyl]-N-(3-oxopropyl)carbamic acid phenyl ester IUPAC Name: phenyl N-[3-(4-methylpiperazin-1-yl)octadecyl]-N-(3-oxopropyl)carbamate Traditional Name: N-(3-ketopropyl)-N-[3-(4-methylpiperazino)octadecyl]carbamic acid phenyl ester Formula: C33H57N3O3 MolecularWeight: 543.82398

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(CCN(CCC=O)C(=O)OC1=CC=CC=C1)N2CCN(CC2)C

Isomeric SMILES

CCCCCCCCCCCCCCCC(CCN(CCC=O)C(=O)OC1=CC=CC=C1)N2CCN(CC2)C

InChI

InChI=1S/C33H57N3O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-16-20-31(35-28-26-34(2)27-29-35)23-25-36(24-19-30-37)33(38)39-32-21-17-15-18-22-32/h15,17-18,21-22,30-31H,3-14,16,19-20,23-29H2,1-2H3