2-[3-[(4-carbamimidoylphenyl)carbamoyl]naphthalen-2-yl]benzoic acid

Systemtic Name: 2-[3-[(4-carbamimidoylphenyl)carbamoyl]naphthalen-2-yl]benzoic acid Openeye Name: 2-[3-[(4-carbamimidoylphenyl)carbamoyl]-2-naphthyl]benzoic acid CAS Name: 2-[3-[(4-carbamimidoylanilino)-oxomethyl]-2-naphthalenyl]benzoic acid IUPAC Name: 2-[3-[(4-carbamimidoylphenyl)carbamoyl]naphthalen-2-yl]benzoic acid Traditional Name: 2-[3-[(4-amidinophenyl)carbamoyl]-2-naphthyl]benzoic acid Formula: C25H19N3O3 MolecularWeight: 409.43666

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C(=CC2=C1)C3=CC=CC=C3C(=O)O)C(=O)NC4=CC=C(C=C4)C(=N)N

Isomeric SMILES

C1=CC=C2C=C(C(=CC2=C1)C3=CC=CC=C3C(=O)O)C(=O)NC4=CC=C(C=C4)C(=N)N

InChI

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