2-[[2-(8-chloranylnaphthalen-1-yl)sulfanylethanoylamino]methyl]-4-nitro-phenolate

Systemtic Name: 2-[[2-(8-chloranylnaphthalen-1-yl)sulfanylethanoylamino]methyl]-4-nitro-phenolate Openeye Name: 2-[[[2-[(8-chloro-1-naphthyl)sulfanyl]acetyl]amino]methyl]-4-nitro-phenolate CAS Name: 2-[[[2-[(8-chloro-1-naphthalenyl)thio]-1-oxoethyl]amino]methyl]-4-nitrophenolate IUPAC Name: 2-[[[2-(8-chloronaphthalen-1-yl)sulfanylacetyl]amino]methyl]-4-nitrophenolate Traditional Name: 2-[[[2-[(8-chloro-1-naphthyl)thio]acetyl]amino]methyl]-4-nitro-phenolate Formula: C19H14ClN2O4S- MolecularWeight: 401.84346

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)SCC(=O)NCC3=C(C=CC(=C3)[N+](=O)[O-])[O-])C(=CC=C2)Cl

Isomeric SMILES

C1=CC2=C(C(=C1)SCC(=O)NCC3=C(C=CC(=C3)[N+](=O)[O-])[O-])C(=CC=C2)Cl

InChI

InChI=1S/C19H15ClN2O4S/c20-15-5-1-3-12-4-2-6-17(19(12)15)27-11-18(24)21-10-13-9-14(22(25)26)7-8-16(13)23/h1-9,23H,10-11H2,(H,21,24)/p-1