3-azanyl-3-(4-octoxyphenyl)propanoic acid

Systemtic Name: 3-azanyl-3-(4-octoxyphenyl)propanoic acid Openeye Name: 3-amino-3-(4-octoxyphenyl)propanoic acid CAS Name: 3-amino-3-(4-octoxyphenyl)propanoic acid IUPAC Name: 3-amino-3-(4-octoxyphenyl)propanoic acid Traditional Name: 3-amino-3-(4-octoxyphenyl)propionic acid Formula: C17H27NO3 MolecularWeight: 293.40118

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C(CC(=O)O)N

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C(CC(=O)O)N

InChI

InChI=1S/C17H27NO3/c1-2-3-4-5-6-7-12-21-15-10-8-14(9-11-15)16(18)13-17(19)20/h8-11,16H,2-7,12-13,18H2,1H3,(H,19,20)