(5-nitrothiophen-3-yl)-(4-phenethylpiperidin-1-yl)methanone

Systemtic Name: (5-nitrothiophen-3-yl)-(4-phenethylpiperidin-1-yl)methanone Openeye Name: (5-nitro-3-thienyl)-(4-phenethyl-1-piperidyl)methanone CAS Name: (5-nitro-3-thiophenyl)-(4-phenethyl-1-piperidinyl)methanone IUPAC Name: (5-nitrothiophen-3-yl)-(4-phenethylpiperidin-1-yl)methanone Traditional Name: (5-nitro-3-thienyl)-(4-phenethylpiperidino)methanone Formula: C18H20N2O3S MolecularWeight: 344.428

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CCC2=CC=CC=C2)C(=O)C3=CSC(=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1CCC2=CC=CC=C2)C(=O)C3=CSC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H20N2O3S/c21-18(16-12-17(20(22)23)24-13-16)19-10-8-15(9-11-19)7-6-14-4-2-1-3-5-14/h1-5,12-13,15H,6-11H2