2-(2-nitrophenyl)propyl 2-sulfanylbenzoate

Systemtic Name: 2-(2-nitrophenyl)propyl 2-sulfanylbenzoate Openeye Name: 2-(2-nitrophenyl)propyl 2-sulfanylbenzoate CAS Name: 2-mercaptobenzoic acid 2-(2-nitrophenyl)propyl ester IUPAC Name: 2-(2-nitrophenyl)propyl 2-sulfanylbenzoate Traditional Name: 2-mercaptobenzoic acid 2-(2-nitrophenyl)propyl ester Formula: C16H15NO4S MolecularWeight: 317.3596

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC(=O)C1=CC=CC=C1S)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC(COC(=O)C1=CC=CC=C1S)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C16H15NO4S/c1-11(12-6-2-4-8-14(12)17(19)20)10-21-16(18)13-7-3-5-9-15(13)22/h2-9,11,22H,10H2,1H3