2-[1-[[(4-ethoxy-3-ethoxycarbonyl-4-oxidanylidene-but-2-en-2-yl)amino]methyl]cyclohexyl]ethanoic acid

Systemtic Name: 2-[1-[[(4-ethoxy-3-ethoxycarbonyl-4-oxidanylidene-but-2-en-2-yl)amino]methyl]cyclohexyl]ethanoic acid Openeye Name: 2-[1-[[(3-ethoxy-2-ethoxycarbonyl-1-methyl-3-oxo-prop-1-enyl)amino]methyl]cyclohexyl]acetic acid CAS Name: 2-[1-[[(4-ethoxy-3-ethoxycarbonyl-4-oxobut-2-en-2-yl)amino]methyl]cyclohexyl]acetic acid IUPAC Name: 2-[1-[[(4-ethoxy-3-ethoxycarbonyl-4-oxobut-2-en-2-yl)amino]methyl]cyclohexyl]acetic acid Traditional Name: 2-[1-[[(2-carbethoxy-3-ethoxy-3-keto-1-methyl-prop-1-enyl)amino]methyl]cyclohexyl]acetic acid Formula: C18H29NO6 MolecularWeight: 355.42596

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C(C)NCC1(CCCCC1)CC(=O)O)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(=C(C)NCC1(CCCCC1)CC(=O)O)C(=O)OCC

InChI

InChI=1S/C18H29NO6/c1-4-24-16(22)15(17(23)25-5-2)13(3)19-12-18(11-14(20)21)9-7-6-8-10-18/h19H,4-12H2,1-3H3,(H,20,21)