2-[2-[(4-carbamimidoylphenyl)carbamoyl]naphthalen-1-yl]benzoic acid

Systemtic Name: 2-[2-[(4-carbamimidoylphenyl)carbamoyl]naphthalen-1-yl]benzoic acid Openeye Name: 2-[2-[(4-carbamimidoylphenyl)carbamoyl]-1-naphthyl]benzoic acid CAS Name: 2-[2-[(4-carbamimidoylanilino)-oxomethyl]-1-naphthalenyl]benzoic acid IUPAC Name: 2-[2-[(4-carbamimidoylphenyl)carbamoyl]naphthalen-1-yl]benzoic acid Traditional Name: 2-[2-[(4-amidinophenyl)carbamoyl]-1-naphthyl]benzoic acid Formula: C25H19N3O3 MolecularWeight: 409.43666

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=C2C3=CC=CC=C3C(=O)O)C(=O)NC4=CC=C(C=C4)C(=N)N

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=C2C3=CC=CC=C3C(=O)O)C(=O)NC4=CC=C(C=C4)C(=N)N

InChI

InChI=1S/C25H19N3O3/c26-23(27)16-9-12-17(13-10-16)28-24(29)21-14-11-15-5-1-2-6-18(15)22(21)19-7-3-4-8-20(19)25(30)31/h1-14H,(H3,26,27)(H,28,29)(H,30,31)