1-[1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)piperidin-4-yl]-N-[(2-nitrophenyl)methyl]methanamine

Systemtic Name: 1-[1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)piperidin-4-yl]-N-[(2-nitrophenyl)methyl]methanamine Openeye Name: 1-[1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-4-piperidyl]-N-[(2-nitrophenyl)methyl]methanamine CAS Name: 1-[1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-4-piperidinyl]-N-[(2-nitrophenyl)methyl]methanamine IUPAC Name: 1-[1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)piperidin-4-yl]-N-[(2-nitrophenyl)methyl]methanamine Traditional Name: [1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-4-piperidyl]methyl-(2-nitrobenzyl)amine Formula: C22H27N3O4 MolecularWeight: 397.46748

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CNCC2=CC=CC=C2[N+](=O)[O-])CC3COC4=CC=CC=C4O3

Isomeric SMILES

C1CN(CCC1CNCC2=CC=CC=C2[N+](=O)[O-])CC3COC4=CC=CC=C4O3

InChI

InChI=1S/C22H27N3O4/c26-25(27)20-6-2-1-5-18(20)14-23-13-17-9-11-24(12-10-17)15-19-16-28-21-7-3-4-8-22(21)29-19/h1-8,17,19,23H,9-16H2