ethanedioic acid; N-[2-(4-methyl-2-nitro-phenoxy)ethyl]prop-2-en-1-amine

Systemtic Name: ethanedioic acid; N-[2-(4-methyl-2-nitro-phenoxy)ethyl]prop-2-en-1-amine Openeye Name: N-[2-(4-methyl-2-nitro-phenoxy)ethyl]prop-2-en-1-amine; oxalic acid CAS Name: N-[2-(4-methyl-2-nitrophenoxy)ethyl]-2-propen-1-amine; oxalic acid IUPAC Name: N-[2-(4-methyl-2-nitrophenoxy)ethyl]prop-2-en-1-amine; oxalic acid Traditional Name: allyl-[2-(4-methyl-2-nitro-phenoxy)ethyl]amine; oxalic acid Formula: C14H18N2O7 MolecularWeight: 326.30192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCCNCC=C)[N+](=O)[O-].C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC(=C(C=C1)OCCNCC=C)[N+](=O)[O-].C(=O)(C(=O)O)O

InChI

InChI=1S/C12H16N2O3.C2H2O4/c1-3-6-13-7-8-17-12-5-4-10(2)9-11(12)14(15)16;3-1(4)2(5)6/h3-5,9,13H,1,6-8H2,2H3;(H,3,4)(H,5,6)