[2-(3-azanyl-3-oxidanylidene-propyl)-3-methyl-phenyl] N-[3-(dimethylamino)propyl]-N-octadecyl-carbamate

Systemtic Name: [2-(3-azanyl-3-oxidanylidene-propyl)-3-methyl-phenyl] N-[3-(dimethylamino)propyl]-N-octadecyl-carbamate Openeye Name: [2-(3-amino-3-oxo-propyl)-3-methyl-phenyl] N-[3-(dimethylamino)propyl]-N-octadecyl-carbamate CAS Name: N-[3-(dimethylamino)propyl]-N-octadecylcarbamic acid [2-(3-amino-3-oxopropyl)-3-methylphenyl] ester IUPAC Name: [2-(3-amino-3-oxopropyl)-3-methylphenyl] N-[3-(dimethylamino)propyl]-N-octadecylcarbamate Traditional Name: N-[3-(dimethylamino)propyl]-N-stearyl-carbamic acid [2-(3-amino-3-keto-propyl)-3-methyl-phenyl] ester Formula: C34H61N3O3 MolecularWeight: 559.86644

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCN(CCCN(C)C)C(=O)OC1=CC=CC(=C1CCC(=O)N)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCN(CCCN(C)C)C(=O)OC1=CC=CC(=C1CCC(=O)N)C

InChI

InChI=1S/C34H61N3O3/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-28-37(29-22-27-36(3)4)34(39)40-32-24-21-23-30(2)31(32)25-26-33(35)38/h21,23-24H,5-20,22,25-29H2,1-4H3,(H2,35,38)