(E)-3-[4-ethoxy-2-[(phenylmethyl)amino]phenyl]but-2-enoic acid

Systemtic Name: (E)-3-[4-ethoxy-2-[(phenylmethyl)amino]phenyl]but-2-enoic acid Openeye Name: (E)-3-[2-(benzylamino)-4-ethoxy-phenyl]but-2-enoic acid CAS Name: (E)-3-[4-ethoxy-2-[(phenylmethyl)amino]phenyl]-2-butenoic acid IUPAC Name: (E)-3-[2-(benzylamino)-4-ethoxyphenyl]but-2-enoic acid Traditional Name: (E)-3-[2-(benzylamino)-4-ethoxy-phenyl]but-2-enoic acid Formula: C19H21NO3 MolecularWeight: 311.37494

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)C(=CC(=O)O)C)NCC2=CC=CC=C2

Isomeric SMILES

CCOC1=CC(=C(C=C1)/C(=C/C(=O)O)/C)NCC2=CC=CC=C2

InChI

InChI=1S/C19H21NO3/c1-3-23-16-9-10-17(14(2)11-19(21)22)18(12-16)20-13-15-7-5-4-6-8-15/h4-12,20H,3,13H2,1-2H3,(H,21,22)/b14-11+