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

Systemtic Name: (4-piperidin-1-ylcarbothioylphenyl) 2-nitrobenzoate Openeye Name: [4-(piperidine-1-carbothioyl)phenyl] 2-nitrobenzoate CAS Name: 2-nitrobenzoic acid [4-[1-piperidinyl(sulfanylidene)methyl]phenyl] ester IUPAC Name: [4-(piperidine-1-carbothioyl)phenyl] 2-nitrobenzoate Traditional Name: 2-nitrobenzoic acid [4-(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=C(C=C2)OC(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

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

InChI

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