dipotassium 7-[[4-[(4-azanyl-1-methyl-pyrrol-2-yl)carbonylamino]-1-methyl-pyrrol-3-yl]carbonylamino]naphthalene-1,3-disulfonate

Systemtic Name: dipotassium 7-[[4-[(4-azanyl-1-methyl-pyrrol-2-yl)carbonylamino]-1-methyl-pyrrol-3-yl]carbonylamino]naphthalene-1,3-disulfonate Openeye Name: dipotassium 7-[[4-[(4-amino-1-methyl-pyrrole-2-carbonyl)amino]-1-methyl-pyrrole-3-carbonyl]amino]naphthalene-1,3-disulfonate CAS Name: dipotassium 7-[[[4-[[(4-amino-1-methyl-2-pyrrolyl)-oxomethyl]amino]-1-methyl-3-pyrrolyl]-oxomethyl]amino]naphthalene-1,3-disulfonate IUPAC Name: dipotassium 7-[[4-[(4-amino-1-methylpyrrole-2-carbonyl)amino]-1-methylpyrrole-3-carbonyl]amino]naphthalene-1,3-disulfonate Traditional Name: dipotassium 7-[[4-[(4-amino-1-methyl-pyrrole-2-carbonyl)amino]-1-methyl-pyrrole-3-carbonyl]amino]naphthalene-1,3-disulfonate Formula: C22H19K2N5O8S2 MolecularWeight: 623.74156

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=C1)NC(=O)C2=CC(=CN2C)N)C(=O)NC3=CC4=C(C=C(C=C4C=C3)S(=O)(=O)[O-])S(=O)(=O)[O-].[K+].[K+]

Isomeric SMILES

CN1C=C(C(=C1)NC(=O)C2=CC(=CN2C)N)C(=O)NC3=CC4=C(C=C(C=C4C=C3)S(=O)(=O)[O-])S(=O)(=O)[O-].[K+].[K+]

InChI

InChI=1S/C22H21N5O8S2.2K/c1-26-10-17(18(11-26)25-22(29)19-6-13(23)9-27(19)2)21(28)24-14-4-3-12-5-15(36(30,31)32)8-20(16(12)7-14)37(33,34)35;;/h3-11H,23H2,1-2H3,(H,24,28)(H,25,29)(H,30,31,32)(H,33,34,35);;/q;2*+1/p-2