3-azanyl-7-[4-(phenylmethyl)phenoxy]heptanoic acid

Systemtic Name: 3-azanyl-7-[4-(phenylmethyl)phenoxy]heptanoic acid Openeye Name: 3-amino-7-(4-benzylphenoxy)heptanoic acid CAS Name: 3-amino-7-[4-(phenylmethyl)phenoxy]heptanoic acid IUPAC Name: 3-amino-7-(4-benzylphenoxy)heptanoic acid Traditional Name: 3-amino-7-(4-benzylphenoxy)enanthic acid Formula: C20H25NO3 MolecularWeight: 327.4174

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CC=C(C=C2)OCCCCC(CC(=O)O)N

Isomeric SMILES

C1=CC=C(C=C1)CC2=CC=C(C=C2)OCCCCC(CC(=O)O)N

InChI

InChI=1S/C20H25NO3/c21-18(15-20(22)23)8-4-5-13-24-19-11-9-17(10-12-19)14-16-6-2-1-3-7-16/h1-3,6-7,9-12,18H,4-5,8,13-15,21H2,(H,22,23)