(2-piperidin-1-ylcarbothioylphenyl) 3-nitrobenzoate

Systemtic Name: (2-piperidin-1-ylcarbothioylphenyl) 3-nitrobenzoate Openeye Name: [2-(piperidine-1-carbothioyl)phenyl] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [2-[1-piperidinyl(sulfanylidene)methyl]phenyl] ester IUPAC Name: [2-(piperidine-1-carbothioyl)phenyl] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [2-(piperidine-1-carbothioyl)phenyl] ester Formula: C19H18N2O4S MolecularWeight: 370.42222

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=S)C2=CC=CC=C2OC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C(=S)C2=CC=CC=C2OC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H18N2O4S/c22-19(14-7-6-8-15(13-14)21(23)24)25-17-10-3-2-9-16(17)18(26)20-11-4-1-5-12-20/h2-3,6-10,13H,1,4-5,11-12H2