4-[2,3-bis(azanyl)-4-phenylmethoxycarbonyl-phenyl]butanoic acid

Systemtic Name: 4-[2,3-bis(azanyl)-4-phenylmethoxycarbonyl-phenyl]butanoic acid Openeye Name: 4-(2,3-diamino-4-benzyloxycarbonyl-phenyl)butanoic acid CAS Name: 4-(2,3-diamino-4-phenylmethoxycarbonylphenyl)butanoic acid IUPAC Name: 4-(2,3-diamino-4-phenylmethoxycarbonylphenyl)butanoic acid Traditional Name: 4-(2,3-diamino-4-carbobenzoxy-phenyl)butyric acid Formula: C18H20N2O4 MolecularWeight: 328.3624

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C2=C(C(=C(C=C2)CCCC(=O)O)N)N

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)C2=C(C(=C(C=C2)CCCC(=O)O)N)N

InChI

InChI=1S/C18H20N2O4/c19-16-13(7-4-8-15(21)22)9-10-14(17(16)20)18(23)24-11-12-5-2-1-3-6-12/h1-3,5-6,9-10H,4,7-8,11,19-20H2,(H,21,22)