2-azanyl-1-[5-[(Z)-3-chloranylprop-1-enyl]-1H-pyrrol-2-yl]-2-oxidanylidene-ethanesulfonic acid

Systemtic Name: 2-azanyl-1-[5-[(Z)-3-chloranylprop-1-enyl]-1H-pyrrol-2-yl]-2-oxidanylidene-ethanesulfonic acid Openeye Name: 2-amino-1-[5-[(Z)-3-chloroprop-1-enyl]-1H-pyrrol-2-yl]-2-oxo-ethanesulfonic acid CAS Name: 2-amino-1-[5-[(Z)-3-chloroprop-1-enyl]-1H-pyrrol-2-yl]-2-oxoethanesulfonic acid IUPAC Name: 2-amino-1-[5-[(Z)-3-chloroprop-1-enyl]-1H-pyrrol-2-yl]-2-oxoethanesulfonic acid Traditional Name: 2-amino-1-[5-[(Z)-3-chloroprop-1-enyl]-1H-pyrrol-2-yl]-2-keto-ethanesulfonic acid Formula: C9H11ClN2O4S MolecularWeight: 278.71264

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(NC(=C1)C(C(=O)N)S(=O)(=O)O)C=CCCl

Isomeric SMILES

C1=C(NC(=C1)C(C(=O)N)S(=O)(=O)O)/C=C\CCl

InChI

InChI=1S/C9H11ClN2O4S/c10-5-1-2-6-3-4-7(12-6)8(9(11)13)17(14,15)16/h1-4,8,12H,5H2,(H2,11,13)(H,14,15,16)/b2-1-