3-[(7-carbamimidoylnaphthalen-1-yl)carbamoyl]benzenesulfonic acid

Systemtic Name: 3-[(7-carbamimidoylnaphthalen-1-yl)carbamoyl]benzenesulfonic acid Openeye Name: 3-[(7-carbamimidoyl-1-naphthyl)carbamoyl]benzenesulfonic acid CAS Name: 3-[[(7-carbamimidoyl-1-naphthalenyl)amino]-oxomethyl]benzenesulfonic acid IUPAC Name: 3-[(7-carbamimidoylnaphthalen-1-yl)carbamoyl]benzenesulfonic acid Traditional Name: 3-[(7-amidino-1-naphthyl)carbamoyl]besylic acid Formula: C18H15N3O4S MolecularWeight: 369.3944

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C(C=C2)C(=N)N)C(=C1)NC(=O)C3=CC(=CC=C3)S(=O)(=O)O

Isomeric SMILES

C1=CC2=C(C=C(C=C2)C(=N)N)C(=C1)NC(=O)C3=CC(=CC=C3)S(=O)(=O)O

InChI

InChI=1S/C18H15N3O4S/c19-17(20)12-8-7-11-3-2-6-16(15(11)10-12)21-18(22)13-4-1-5-14(9-13)26(23,24)25/h1-10H,(H3,19,20)(H,21,22)(H,23,24,25)