ethyl 2-azanyl-7-[4-(phenylmethyl)phenoxy]heptanoate hydrochloride

Systemtic Name: ethyl 2-azanyl-7-[4-(phenylmethyl)phenoxy]heptanoate hydrochloride Openeye Name: ethyl 2-amino-7-(4-benzylphenoxy)heptanoate hydrochloride CAS Name: 2-amino-7-[4-(phenylmethyl)phenoxy]heptanoic acid ethyl ester hydrochloride IUPAC Name: ethyl 2-amino-7-(4-benzylphenoxy)heptanoate hydrochloride Traditional Name: 2-amino-7-(4-benzylphenoxy)enanthic acid ethyl ester hydrochloride Formula: C22H30ClNO3 MolecularWeight: 391.9315

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCCCCOC1=CC=C(C=C1)CC2=CC=CC=C2)N.Cl

Isomeric SMILES

CCOC(=O)C(CCCCCOC1=CC=C(C=C1)CC2=CC=CC=C2)N.Cl

InChI

InChI=1S/C22H29NO3.ClH/c1-2-25-22(24)21(23)11-7-4-8-16-26-20-14-12-19(13-15-20)17-18-9-5-3-6-10-18;/h3,5-6,9-10,12-15,21H,2,4,7-8,11,16-17,23H2,1H3;1H