2,6-bis(azanyl)hexanoic acid; 2-(3-chloranyl-4-prop-2-enoxy-phenyl)ethanoic acid

Systemtic Name: 2,6-bis(azanyl)hexanoic acid; 2-(3-chloranyl-4-prop-2-enoxy-phenyl)ethanoic acid Openeye Name: 2-(4-allyloxy-3-chloro-phenyl)acetic acid; 2,6-diaminohexanoic acid CAS Name: 2-(3-chloro-4-prop-2-enoxyphenyl)acetic acid; 2,6-diaminohexanoic acid IUPAC Name: 2-(3-chloro-4-prop-2-enoxyphenyl)acetic acid; 2,6-diaminohexanoic acid Traditional Name: 2-(4-allyloxy-3-chloro-phenyl)acetic acid; 2,6-diaminohexanoic acid Formula: C17H25ClN2O5 MolecularWeight: 372.8438

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC1=C(C=C(C=C1)CC(=O)O)Cl.C(CCN)CC(C(=O)O)N

Isomeric SMILES

C=CCOC1=C(C=C(C=C1)CC(=O)O)Cl.C(CCN)CC(C(=O)O)N

InChI

InChI=1S/C11H11ClO3.C6H14N2O2/c1-2-5-15-10-4-3-8(6-9(10)12)7-11(13)14;7-4-2-1-3-5(8)6(9)10/h2-4,6H,1,5,7H2,(H,13,14);5H,1-4,7-8H2,(H,9,10)