4-[bis(azanyl)methylideneamino]-2-carbamimidoyl-6-naphthalen-2-yl-benzoic acid

Systemtic Name: 4-[bis(azanyl)methylideneamino]-2-carbamimidoyl-6-naphthalen-2-yl-benzoic acid Openeye Name: 2-carbamimidoyl-4-guanidino-6-(2-naphthyl)benzoic acid CAS Name: 2-carbamimidoyl-4-(diaminomethylideneamino)-6-(2-naphthalenyl)benzoic acid IUPAC Name: 2-carbamimidoyl-4-(diaminomethylideneamino)-6-naphthalen-2-ylbenzoic acid Traditional Name: 2-amidino-4-guanidino-6-(2-naphthyl)benzoic acid Formula: C19H17N5O2 MolecularWeight: 347.37058

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)C3=CC(=CC(=C3C(=O)O)C(=N)N)N=C(N)N

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)C3=CC(=CC(=C3C(=O)O)C(=N)N)N=C(N)N

InChI

InChI=1S/C19H17N5O2/c20-17(21)15-9-13(24-19(22)23)8-14(16(15)18(25)26)12-6-5-10-3-1-2-4-11(10)7-12/h1-9H,(H3,20,21)(H,25,26)(H4,22,23,24)