2-azanyl-4-(4-phenoxyphenoxy)pentanedioic acid

Systemtic Name: 2-azanyl-4-(4-phenoxyphenoxy)pentanedioic acid Openeye Name: 2-amino-4-(4-phenoxyphenoxy)pentanedioic acid CAS Name: 2-amino-4-(4-phenoxyphenoxy)pentanedioic acid IUPAC Name: 2-amino-4-(4-phenoxyphenoxy)pentanedioic acid Traditional Name: 2-amino-4-(4-phenoxyphenoxy)glutaric acid Formula: C17H17NO6 MolecularWeight: 331.31998

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)OC(CC(C(=O)O)N)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)OC(CC(C(=O)O)N)C(=O)O

InChI

InChI=1S/C17H17NO6/c18-14(16(19)20)10-15(17(21)22)24-13-8-6-12(7-9-13)23-11-4-2-1-3-5-11/h1-9,14-15H,10,18H2,(H,19,20)(H,21,22)