[2-(2-nitrophenyl)sulfanylphenyl]-piperidin-1-yl-methanone

Systemtic Name: [2-(2-nitrophenyl)sulfanylphenyl]-piperidin-1-yl-methanone Openeye Name: [2-(2-nitrophenyl)sulfanylphenyl]-(1-piperidyl)methanone CAS Name: [2-[(2-nitrophenyl)thio]phenyl]-(1-piperidinyl)methanone IUPAC Name: [2-(2-nitrophenyl)sulfanylphenyl]-piperidin-1-ylmethanone Traditional Name: [2-[(2-nitrophenyl)thio]phenyl]-piperidino-methanone Formula: C18H18N2O3S MolecularWeight: 342.41212

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2=CC=CC=C2SC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C(=O)C2=CC=CC=C2SC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C18H18N2O3S/c21-18(19-12-6-1-7-13-19)14-8-2-4-10-16(14)24-17-11-5-3-9-15(17)20(22)23/h2-5,8-11H,1,6-7,12-13H2