7-[[9,10-bis(oxidanylidene)-8a,10a-dihydroanthracen-2-yl]carbamoylamino]-4-oxidanyl-naphthalene-2-sulfonic acid

Systemtic Name: 7-[[9,10-bis(oxidanylidene)-8a,10a-dihydroanthracen-2-yl]carbamoylamino]-4-oxidanyl-naphthalene-2-sulfonic acid Openeye Name: 7-[(9,10-dioxo-8a,10a-dihydroanthracen-2-yl)carbamoylamino]-4-hydroxy-naphthalene-2-sulfonic acid CAS Name: 7-[[[(9,10-dioxo-8a,10a-dihydroanthracen-2-yl)amino]-oxomethyl]amino]-4-hydroxy-2-naphthalenesulfonic acid IUPAC Name: 7-[(9,10-dioxo-8a,10a-dihydroanthracen-2-yl)carbamoylamino]-4-hydroxynaphthalene-2-sulfonic acid Traditional Name: 7-[(9,10-diketo-8a,10a-dihydroanthracen-2-yl)carbamoylamino]-4-hydroxy-naphthalene-2-sulfonic acid Formula: C25H18N2O7S MolecularWeight: 490.48462

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2C(C=C1)C(=O)C3=C(C2=O)C=CC(=C3)NC(=O)NC4=CC5=CC(=CC(=C5C=C4)O)S(=O)(=O)O

Isomeric SMILES

C1=CC2C(C=C1)C(=O)C3=C(C2=O)C=CC(=C3)NC(=O)NC4=CC5=CC(=CC(=C5C=C4)O)S(=O)(=O)O

InChI

InChI=1S/C25H18N2O7S/c28-22-12-16(35(32,33)34)10-13-9-14(5-7-17(13)22)26-25(31)27-15-6-8-20-21(11-15)24(30)19-4-2-1-3-18(19)23(20)29/h1-12,18-19,28H,(H2,26,27,31)(H,32,33,34)