N-[1-(1,3-benzodioxol-5-yl)ethyl]-3-nitro-aniline

Systemtic Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-3-nitro-aniline Openeye Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-3-nitro-aniline CAS Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-3-nitroaniline IUPAC Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-3-nitroaniline Traditional Name: 1-(1,3-benzodioxol-5-yl)ethyl-(3-nitrophenyl)amine Formula: C15H14N2O4 MolecularWeight: 286.28266

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCO2)NC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C1=CC2=C(C=C1)OCO2)NC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H14N2O4/c1-10(11-5-6-14-15(7-11)21-9-20-14)16-12-3-2-4-13(8-12)17(18)19/h2-8,10,16H,9H2,1H3