(E)-3-[3-methoxy-4-[2-(2-methylpropylamino)-2-oxidanylidene-ethoxy]phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[3-methoxy-4-[2-(2-methylpropylamino)-2-oxidanylidene-ethoxy]phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-[2-(isobutylamino)-2-oxo-ethoxy]-3-methoxy-phenyl]prop-2-enoic acid CAS Name: (E)-3-[3-methoxy-4-[2-(2-methylpropylamino)-2-oxoethoxy]phenyl]-2-propenoic acid IUPAC Name: (E)-3-[3-methoxy-4-[2-(2-methylpropylamino)-2-oxoethoxy]phenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-[2-(isobutylamino)-2-keto-ethoxy]-3-methoxy-phenyl]acrylic acid Formula: C16H21NO5 MolecularWeight: 307.34164

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)COC1=C(C=C(C=C1)C=CC(=O)O)OC

Isomeric SMILES

CC(C)CNC(=O)COC1=C(C=C(C=C1)/C=C/C(=O)O)OC

InChI

InChI=1S/C16H21NO5/c1-11(2)9-17-15(18)10-22-13-6-4-12(5-7-16(19)20)8-14(13)21-3/h4-8,11H,9-10H2,1-3H3,(H,17,18)(H,19,20)/b7-5+