2-(9-methylpentadecylamino)ethyl 4-azanylbenzoate hydrochloride

Systemtic Name: 2-(9-methylpentadecylamino)ethyl 4-azanylbenzoate hydrochloride Openeye Name: 2-(9-methylpentadecylamino)ethyl 4-aminobenzoate hydrochloride CAS Name: 4-aminobenzoic acid 2-(9-methylpentadecylamino)ethyl ester hydrochloride IUPAC Name: 2-(9-methylpentadecylamino)ethyl 4-aminobenzoate hydrochloride Traditional Name: 4-aminobenzoic acid 2-(9-methylpentadecylamino)ethyl ester hydrochloride Formula: C25H45ClN2O2 MolecularWeight: 441.09

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)CCCCCCCCNCCOC(=O)C1=CC=C(C=C1)N.Cl

Isomeric SMILES

CCCCCCC(C)CCCCCCCCNCCOC(=O)C1=CC=C(C=C1)N.Cl

InChI

InChI=1S/C25H44N2O2.ClH/c1-3-4-5-10-13-22(2)14-11-8-6-7-9-12-19-27-20-21-29-25(28)23-15-17-24(26)18-16-23;/h15-18,22,27H,3-14,19-21,26H2,1-2H3;1H