ethyl (E)-3-[[5-(hydroxymethyl)-2-propan-2-yl-phenyl]amino]but-2-enoate

Systemtic Name: ethyl (E)-3-[[5-(hydroxymethyl)-2-propan-2-yl-phenyl]amino]but-2-enoate Openeye Name: ethyl (E)-3-[5-(hydroxymethyl)-2-isopropyl-anilino]but-2-enoate CAS Name: (E)-3-[5-(hydroxymethyl)-2-propan-2-ylanilino]-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[5-(hydroxymethyl)-2-propan-2-ylanilino]but-2-enoate Traditional Name: (E)-3-(2-isopropyl-5-methylol-anilino)but-2-enoic acid ethyl ester Formula: C16H23NO3 MolecularWeight: 277.35872

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=C(C)NC1=C(C=CC(=C1)CO)C(C)C

Isomeric SMILES

CCOC(=O)/C=C(\C)/NC1=C(C=CC(=C1)CO)C(C)C

InChI

InChI=1S/C16H23NO3/c1-5-20-16(19)8-12(4)17-15-9-13(10-18)6-7-14(15)11(2)3/h6-9,11,17-18H,5,10H2,1-4H3/b12-8+