N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-1-(2-nitrophenyl)piperidine-4-carboxamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-1-(2-nitrophenyl)piperidine-4-carboxamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-1-(2-nitrophenyl)piperidine-4-carboxamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-1-(2-nitrophenyl)-4-piperidinecarboxamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-1-(2-nitrophenyl)piperidine-4-carboxamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-1-(2-nitrophenyl)isonipecotamide Formula: C21H23N3O5 MolecularWeight: 397.42442

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCC2=CC3=C(C=C2)OCCO3)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1C(=O)NCC2=CC3=C(C=C2)OCCO3)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C21H23N3O5/c25-21(22-14-15-5-6-19-20(13-15)29-12-11-28-19)16-7-9-23(10-8-16)17-3-1-2-4-18(17)24(26)27/h1-6,13,16H,7-12,14H2,(H,22,25)