N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-methyl-1-(3-nitrophenyl)ethanamine

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-methyl-1-(3-nitrophenyl)ethanamine Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-methyl-1-(3-nitrophenyl)ethanamine CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-methyl-1-(3-nitrophenyl)ethanamine IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-methyl-1-(3-nitrophenyl)ethanamine Traditional Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-methyl-[1-(3-nitrophenyl)ethyl]amine Formula: C18H20N2O4 MolecularWeight: 328.3624

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)[N+](=O)[O-])N(C)CC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CC(C1=CC(=CC=C1)[N+](=O)[O-])N(C)CC2=CC3=C(C=C2)OCCO3

InChI

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