2-[[4-[(3,5-dinitrothiophen-2-yl)diazenyl]naphthalen-1-yl]-(2-hydroxyethyl)amino]ethanol

Systemtic Name: 2-[[4-[(3,5-dinitrothiophen-2-yl)diazenyl]naphthalen-1-yl]-(2-hydroxyethyl)amino]ethanol Openeye Name: 2-[[4-[(3,5-dinitro-2-thienyl)azo]-1-naphthyl]-(2-hydroxyethyl)amino]ethanol CAS Name: 2-[[4-[(3,5-dinitro-2-thiophenyl)azo]-1-naphthalenyl]-(2-hydroxyethyl)amino]ethanol IUPAC Name: 2-[[4-[(3,5-dinitrothiophen-2-yl)diazenyl]naphthalen-1-yl]-(2-hydroxyethyl)amino]ethanol Traditional Name: 2-[[4-[(3,5-dinitro-2-thienyl)azo]-1-naphthyl]-(2-hydroxyethyl)amino]ethanol Formula: C18H17N5O6S MolecularWeight: 431.42248

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC=C2N(CCO)CCO)N=NC3=C(C=C(S3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC=C2N(CCO)CCO)N=NC3=C(C=C(S3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C18H17N5O6S/c24-9-7-21(8-10-25)15-6-5-14(12-3-1-2-4-13(12)15)19-20-18-16(22(26)27)11-17(30-18)23(28)29/h1-6,11,24-25H,7-10H2