[2-(octadecylcarbamoyl)phenyl]methyl N-(2-dimethylaminoethyl)carbamate hydrochloride

Systemtic Name: [2-(octadecylcarbamoyl)phenyl]methyl N-(2-dimethylaminoethyl)carbamate hydrochloride Openeye Name: [2-(octadecylcarbamoyl)phenyl]methyl N-(2-dimethylaminoethyl)carbamate hydrochloride CAS Name: N-(2-dimethylaminoethyl)carbamic acid [2-[(octadecylamino)-oxomethyl]phenyl]methyl ester hydrochloride IUPAC Name: [2-(octadecylcarbamoyl)phenyl]methyl N-(2-dimethylaminoethyl)carbamate hydrochloride Traditional Name: N-(2-dimethylaminoethyl)carbamic acid [2-(stearylcarbamoyl)benzyl] ester hydrochloride Formula: C31H56ClN3O3 MolecularWeight: 554.24764

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)C1=CC=CC=C1COC(=O)NCCN(C)C.Cl

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)C1=CC=CC=C1COC(=O)NCCN(C)C.Cl

InChI

InChI=1S/C31H55N3O3.ClH/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-24-32-30(35)29-23-20-19-22-28(29)27-37-31(36)33-25-26-34(2)3;/h19-20,22-23H,4-18,21,24-27H2,1-3H3,(H,32,35)(H,33,36);1H