4-chloranylbutyl 2-azanyl-3-(4-methoxyphenyl)propanoate hydrochloride

Systemtic Name: 4-chloranylbutyl 2-azanyl-3-(4-methoxyphenyl)propanoate hydrochloride Openeye Name: 4-chlorobutyl 2-amino-3-(4-methoxyphenyl)propanoate hydrochloride CAS Name: 2-amino-3-(4-methoxyphenyl)propanoic acid 4-chlorobutyl ester hydrochloride IUPAC Name: 4-chlorobutyl 2-amino-3-(4-methoxyphenyl)propanoate hydrochloride Traditional Name: 2-amino-3-(4-methoxyphenyl)propionic acid 4-chlorobutyl ester hydrochloride Formula: C14H21Cl2NO3 MolecularWeight: 322.22744

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC(C(=O)OCCCCCl)N.Cl

Isomeric SMILES

COC1=CC=C(C=C1)CC(C(=O)OCCCCCl)N.Cl

InChI

InChI=1S/C14H20ClNO3.ClH/c1-18-12-6-4-11(5-7-12)10-13(16)14(17)19-9-3-2-8-15;/h4-7,13H,2-3,8-10,16H2,1H3;1H