sodium 2-[2-[[[(E)-4-ethoxy-4-oxidanylidene-but-2-en-2-yl]amino]methyl]cyclohexa-1,4-dien-1-yl]ethanoate

Systemtic Name: sodium 2-[2-[[[(E)-4-ethoxy-4-oxidanylidene-but-2-en-2-yl]amino]methyl]cyclohexa-1,4-dien-1-yl]ethanoate Openeye Name: sodium 2-[2-[[[(E)-3-ethoxy-1-methyl-3-oxo-prop-1-enyl]amino]methyl]cyclohexa-1,4-dien-1-yl]acetate CAS Name: sodium 2-[2-[[[(E)-4-ethoxy-4-oxobut-2-en-2-yl]amino]methyl]-1-cyclohexa-1,4-dienyl]acetate IUPAC Name: sodium 2-[2-[[[(E)-4-ethoxy-4-oxobut-2-en-2-yl]amino]methyl]cyclohexa-1,4-dien-1-yl]acetate Traditional Name: sodium 2-[2-[[[(E)-3-ethoxy-3-keto-1-methyl-prop-1-enyl]amino]methyl]cyclohexa-1,4-dien-1-yl]acetate Formula: C15H20NNaO4 MolecularWeight: 301.31337

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=C(C)NCC1=C(CC=CC1)CC(=O)[O-].[Na+]

Isomeric SMILES

CCOC(=O)/C=C(\C)/NCC1=C(CC=CC1)CC(=O)[O-].[Na+]

InChI

InChI=1S/C15H21NO4.Na/c1-3-20-15(19)8-11(2)16-10-13-7-5-4-6-12(13)9-14(17)18;/h4-5,8,16H,3,6-7,9-10H2,1-2H3,(H,17,18);/q;+1/p-1/b11-8+;