N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-1-(2-nitrophenyl)piperidine-4-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-1-(2-nitrophenyl)piperidine-4-carboxamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-1-(2-nitrophenyl)piperidine-4-carboxamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-1-(2-nitrophenyl)-4-piperidinecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-1-(2-nitrophenyl)piperidine-4-carboxamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-1-(2-nitrophenyl)isonipecotamide Formula: C21H22N4O3S MolecularWeight: 410.48938

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC2=CC=CC=C2S1)C(=O)C3CCN(CC3)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

CN(CC1=NC2=CC=CC=C2S1)C(=O)C3CCN(CC3)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C21H22N4O3S/c1-23(14-20-22-16-6-2-5-9-19(16)29-20)21(26)15-10-12-24(13-11-15)17-7-3-4-8-18(17)25(27)28/h2-9,15H,10-14H2,1H3