N-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]-N-(phenylmethyl)ethanamine

Systemtic Name: N-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]-N-(phenylmethyl)ethanamine Openeye Name: N-benzyl-N-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]ethanamine CAS Name: N-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]-N-(phenylmethyl)ethanamine IUPAC Name: N-benzyl-N-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]ethanamine Traditional Name: benzyl-ethyl-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]amine Formula: C18H20N2O4 MolecularWeight: 328.3624

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)CC2=C3C(=CC(=C2)[N+](=O)[O-])COCO3

Isomeric SMILES

CCN(CC1=CC=CC=C1)CC2=C3C(=CC(=C2)[N+](=O)[O-])COCO3

InChI

InChI=1S/C18H20N2O4/c1-2-19(10-14-6-4-3-5-7-14)11-15-8-17(20(21)22)9-16-12-23-13-24-18(15)16/h3-9H,2,10-13H2,1H3