5-[(7-azanyl-3-sulfo-naphthalen-1-yl)diazenyl]naphthalene-2-carboxylic acid

Systemtic Name: 5-[(7-azanyl-3-sulfo-naphthalen-1-yl)diazenyl]naphthalene-2-carboxylic acid Openeye Name: 5-[(7-amino-3-sulfo-1-naphthyl)azo]naphthalene-2-carboxylic acid CAS Name: 5-[(7-amino-3-sulfo-1-naphthalenyl)azo]-2-naphthalenecarboxylic acid IUPAC Name: 5-[(7-amino-3-sulfonaphthalen-1-yl)diazenyl]naphthalene-2-carboxylic acid Traditional Name: 5-[(7-amino-3-sulfo-1-naphthyl)azo]-2-naphthoic acid Formula: C21H15N3O5S MolecularWeight: 421.4259

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=C2)C(=O)O)C(=C1)N=NC3=C4C=C(C=CC4=CC(=C3)S(=O)(=O)O)N

Isomeric SMILES

C1=CC2=C(C=CC(=C2)C(=O)O)C(=C1)N=NC3=C4C=C(C=CC4=CC(=C3)S(=O)(=O)O)N

InChI

InChI=1S/C21H15N3O5S/c22-15-6-4-13-9-16(30(27,28)29)11-20(18(13)10-15)24-23-19-3-1-2-12-8-14(21(25)26)5-7-17(12)19/h1-11H,22H2,(H,25,26)(H,27,28,29)