3-[4-[4-[bis(azanyl)methylideneamino]phenyl]carbonyloxyphenyl]propanoic acid

Systemtic Name: 3-[4-[4-[bis(azanyl)methylideneamino]phenyl]carbonyloxyphenyl]propanoic acid Openeye Name: 3-[4-(4-guanidinobenzoyl)oxyphenyl]propanoic acid CAS Name: 3-[4-[[4-(diaminomethylideneamino)phenyl]-oxomethoxy]phenyl]propanoic acid IUPAC Name: 3-[4-[4-(diaminomethylideneamino)benzoyl]oxyphenyl]propanoic acid Traditional Name: 3-[4-(4-guanidinobenzoyl)oxyphenyl]propionic acid Formula: C17H17N3O4 MolecularWeight: 327.33458

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCC(=O)O)OC(=O)C2=CC=C(C=C2)N=C(N)N

Isomeric SMILES

C1=CC(=CC=C1CCC(=O)O)OC(=O)C2=CC=C(C=C2)N=C(N)N

InChI

InChI=1S/C17H17N3O4/c18-17(19)20-13-6-4-12(5-7-13)16(23)24-14-8-1-11(2-9-14)3-10-15(21)22/h1-2,4-9H,3,10H2,(H,21,22)(H4,18,19,20)