phenyl 2-azanyl-3-[3-(dimethylamino)propyl]-2-(3-oxidanylidenepropyl)octadecanoate

Systemtic Name: phenyl 2-azanyl-3-[3-(dimethylamino)propyl]-2-(3-oxidanylidenepropyl)octadecanoate Openeye Name: phenyl 2-amino-3-[3-(dimethylamino)propyl]-2-(3-oxopropyl)octadecanoate CAS Name: 2-amino-3-[3-(dimethylamino)propyl]-2-(3-oxopropyl)octadecanoic acid phenyl ester IUPAC Name: phenyl 2-amino-3-[3-(dimethylamino)propyl]-2-(3-oxopropyl)octadecanoate Traditional Name: 2-amino-3-[3-(dimethylamino)propyl]-2-(3-ketopropyl)stearic acid phenyl ester Formula: C32H56N2O3 MolecularWeight: 516.79864

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(CCCN(C)C)C(CCC=O)(C(=O)OC1=CC=CC=C1)N

Isomeric SMILES

CCCCCCCCCCCCCCCC(CCCN(C)C)C(CCC=O)(C(=O)OC1=CC=CC=C1)N

InChI

InChI=1S/C32H56N2O3/c1-4-5-6-7-8-9-10-11-12-13-14-15-17-22-29(23-20-27-34(2)3)32(33,26-21-28-35)31(36)37-30-24-18-16-19-25-30/h16,18-19,24-25,28-29H,4-15,17,20-23,26-27,33H2,1-3H3