N-[(2-methoxyphenyl)methyl]-1-(2-nitrophenyl)-N-(thiophen-2-ylmethyl)piperidine-4-carboxamide

Systemtic Name: N-[(2-methoxyphenyl)methyl]-1-(2-nitrophenyl)-N-(thiophen-2-ylmethyl)piperidine-4-carboxamide Openeye Name: N-[(2-methoxyphenyl)methyl]-1-(2-nitrophenyl)-N-(2-thienylmethyl)piperidine-4-carboxamide CAS Name: N-[(2-methoxyphenyl)methyl]-1-(2-nitrophenyl)-N-(thiophen-2-ylmethyl)-4-piperidinecarboxamide IUPAC Name: N-[(2-methoxyphenyl)methyl]-1-(2-nitrophenyl)-N-(thiophen-2-ylmethyl)piperidine-4-carboxamide Traditional Name: 1-(2-nitrophenyl)-N-o-anisyl-N-(2-thenyl)isonipecotamide Formula: C25H27N3O4S MolecularWeight: 465.56458

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CN(CC2=CC=CS2)C(=O)C3CCN(CC3)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC=C1CN(CC2=CC=CS2)C(=O)C3CCN(CC3)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C25H27N3O4S/c1-32-24-11-5-2-7-20(24)17-27(18-21-8-6-16-33-21)25(29)19-12-14-26(15-13-19)22-9-3-4-10-23(22)28(30)31/h2-11,16,19H,12-15,17-18H2,1H3