4-[[4-[(4-sulfonaphthalen-1-yl)carbamoyl]phenyl]carbonylamino]naphthalene-1-sulfonic acid

Systemtic Name: 4-[[4-[(4-sulfonaphthalen-1-yl)carbamoyl]phenyl]carbonylamino]naphthalene-1-sulfonic acid Openeye Name: 4-[[4-[(4-sulfo-1-naphthyl)carbamoyl]benzoyl]amino]naphthalene-1-sulfonic acid CAS Name: 4-[[oxo-[4-[oxo-[(4-sulfo-1-naphthalenyl)amino]methyl]phenyl]methyl]amino]-1-naphthalenesulfonic acid IUPAC Name: 4-[[4-[(4-sulfonaphthalen-1-yl)carbamoyl]benzoyl]amino]naphthalene-1-sulfonic acid Traditional Name: 4-[[4-[(4-sulfo-1-naphthyl)carbamoyl]benzoyl]amino]naphthalene-1-sulfonic acid Formula: C28H20N2O8S2 MolecularWeight: 576.597

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC=C2S(=O)(=O)O)NC(=O)C3=CC=C(C=C3)C(=O)NC4=CC=C(C5=CC=CC=C54)S(=O)(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC=C2S(=O)(=O)O)NC(=O)C3=CC=C(C=C3)C(=O)NC4=CC=C(C5=CC=CC=C54)S(=O)(=O)O

InChI

InChI=1S/C28H20N2O8S2/c31-27(29-23-13-15-25(39(33,34)35)21-7-3-1-5-19(21)23)17-9-11-18(12-10-17)28(32)30-24-14-16-26(40(36,37)38)22-8-4-2-6-20(22)24/h1-16H,(H,29,31)(H,30,32)(H,33,34,35)(H,36,37,38)