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

Systemtic Name: 2-[2-[[[(E)-4-ethoxy-4-oxidanylidene-but-2-en-2-yl]amino]methyl]cyclohexa-1,4-dien-1-yl]ethanoic acid Openeye Name: 2-[2-[[[(E)-3-ethoxy-1-methyl-3-oxo-prop-1-enyl]amino]methyl]cyclohexa-1,4-dien-1-yl]acetic acid CAS Name: 2-[2-[[[(E)-4-ethoxy-4-oxobut-2-en-2-yl]amino]methyl]-1-cyclohexa-1,4-dienyl]acetic acid IUPAC Name: 2-[2-[[[(E)-4-ethoxy-4-oxobut-2-en-2-yl]amino]methyl]cyclohexa-1,4-dien-1-yl]acetic acid Traditional Name: 2-[2-[[[(E)-3-ethoxy-3-keto-1-methyl-prop-1-enyl]amino]methyl]cyclohexa-1,4-dien-1-yl]acetic acid Formula: C15H21NO4 MolecularWeight: 279.33154

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=C(C)NCC1=C(CC=CC1)CC(=O)O

Isomeric SMILES

CCOC(=O)/C=C(\C)/NCC1=C(CC=CC1)CC(=O)O

InChI

InChI=1S/C15H21NO4/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)/b11-8+