2-[[4-[(4-carbamimidoylphenyl)carbamoyl]phenyl]sulfonylamino]butanedioic acid

Systemtic Name: 2-[[4-[(4-carbamimidoylphenyl)carbamoyl]phenyl]sulfonylamino]butanedioic acid Openeye Name: 2-[[4-[(4-carbamimidoylphenyl)carbamoyl]phenyl]sulfonylamino]butanedioic acid CAS Name: 2-[[4-[(4-carbamimidoylanilino)-oxomethyl]phenyl]sulfonylamino]butanedioic acid IUPAC Name: 2-[[4-[(4-carbamimidoylphenyl)carbamoyl]phenyl]sulfonylamino]butanedioic acid Traditional Name: 2-[[4-[(4-amidinophenyl)carbamoyl]phenyl]sulfonylamino]succinic acid Formula: C18H18N4O7S MolecularWeight: 434.42312

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=N)N)NC(=O)C2=CC=C(C=C2)S(=O)(=O)NC(CC(=O)O)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1C(=N)N)NC(=O)C2=CC=C(C=C2)S(=O)(=O)NC(CC(=O)O)C(=O)O

InChI

InChI=1S/C18H18N4O7S/c19-16(20)10-1-5-12(6-2-10)21-17(25)11-3-7-13(8-4-11)30(28,29)22-14(18(26)27)9-15(23)24/h1-8,14,22H,9H2,(H3,19,20)(H,21,25)(H,23,24)(H,26,27)