(E)-4-[[4-[bis(azanyl)methylideneazaniumylsulfonyl]phenyl]amino]-4-oxidanylidene-but-2-enoate

Systemtic Name: (E)-4-[[4-[bis(azanyl)methylideneazaniumylsulfonyl]phenyl]amino]-4-oxidanylidene-but-2-enoate Openeye Name: (E)-4-[4-(diaminomethyleneammoniosulfonyl)anilino]-4-oxo-but-2-enoate CAS Name: (E)-4-[4-(diaminomethylideneammoniosulfonyl)anilino]-4-oxo-2-butenoate IUPAC Name: (E)-4-[4-(diaminomethylideneazaniumylsulfonyl)anilino]-4-oxobut-2-enoate Traditional Name: (E)-4-[4-(diaminomethyleneammoniosulfonyl)anilino]-4-keto-but-2-enoate Formula: C11H12N4O5S MolecularWeight: 312.30178

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)C=CC(=O)[O-])S(=O)(=O)[NH+]=C(N)N

Isomeric SMILES

C1=CC(=CC=C1NC(=O)/C=C/C(=O)[O-])S(=O)(=O)[NH+]=C(N)N

InChI

InChI=1S/C11H12N4O5S/c12-11(13)15-21(19,20)8-3-1-7(2-4-8)14-9(16)5-6-10(17)18/h1-6H,(H,14,16)(H,17,18)(H4,12,13,15)/b6-5+