(3-nitrophenyl) 2-(8-chloranylnaphthalen-1-yl)sulfanylethanoate

Systemtic Name: (3-nitrophenyl) 2-(8-chloranylnaphthalen-1-yl)sulfanylethanoate Openeye Name: (3-nitrophenyl) 2-[(8-chloro-1-naphthyl)sulfanyl]acetate CAS Name: 2-[(8-chloro-1-naphthalenyl)thio]acetic acid (3-nitrophenyl) ester IUPAC Name: (3-nitrophenyl) 2-(8-chloronaphthalen-1-yl)sulfanylacetate Traditional Name: 2-[(8-chloro-1-naphthyl)thio]acetic acid (3-nitrophenyl) ester Formula: C18H12ClNO4S MolecularWeight: 373.81018

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)SCC(=O)OC3=CC=CC(=C3)[N+](=O)[O-])C(=CC=C2)Cl

Isomeric SMILES

C1=CC2=C(C(=C1)SCC(=O)OC3=CC=CC(=C3)[N+](=O)[O-])C(=CC=C2)Cl

InChI

InChI=1S/C18H12ClNO4S/c19-15-8-1-4-12-5-2-9-16(18(12)15)25-11-17(21)24-14-7-3-6-13(10-14)20(22)23/h1-10H,11H2