strontium 4-[(3-chloranyl-4-methyl-5-sulfo-phenyl)diazenyl]-3-oxidanidyl-naphthalene-2-carboxylate

Systemtic Name: strontium 4-[(3-chloranyl-4-methyl-5-sulfo-phenyl)diazenyl]-3-oxidanidyl-naphthalene-2-carboxylate Openeye Name: strontium 4-(3-chloro-4-methyl-5-sulfo-phenyl)azo-3-oxido-naphthalene-2-carboxylate CAS Name: strontium 4-(3-chloro-4-methyl-5-sulfophenyl)azo-3-oxido-2-naphthalenecarboxylate IUPAC Name: strontium 4-[(3-chloro-4-methyl-5-sulfophenyl)diazenyl]-3-oxidonaphthalene-2-carboxylate Traditional Name: strontium 4-(3-chloro-4-methyl-5-sulfo-phenyl)azo-3-oxido-2-naphthoate Formula: C18H11ClN2O6SSr MolecularWeight: 506.42774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1Cl)N=NC2=C(C(=CC3=CC=CC=C32)C(=O)[O-])[O-])S(=O)(=O)O.[Sr+2]

Isomeric SMILES

CC1=C(C=C(C=C1Cl)N=NC2=C(C(=CC3=CC=CC=C32)C(=O)[O-])[O-])S(=O)(=O)O.[Sr+2]

InChI

InChI=1S/C18H13ClN2O6S.Sr/c1-9-14(19)7-11(8-15(9)28(25,26)27)20-21-16-12-5-3-2-4-10(12)6-13(17(16)22)18(23)24;/h2-8,22H,1H3,(H,23,24)(H,25,26,27);/q;+2/p-2