[(2R)-1-(cycloheptylamino)-1-oxidanylidene-propan-2-yl] (E)-3-(2-ethoxyphenyl)prop-2-enoate

Systemtic Name: [(2R)-1-(cycloheptylamino)-1-oxidanylidene-propan-2-yl] (E)-3-(2-ethoxyphenyl)prop-2-enoate Openeye Name: [(1R)-2-(cycloheptylamino)-1-methyl-2-oxo-ethyl] (E)-3-(2-ethoxyphenyl)prop-2-enoate CAS Name: (E)-3-(2-ethoxyphenyl)-2-propenoic acid [(2R)-1-(cycloheptylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(cycloheptylamino)-1-oxopropan-2-yl] (E)-3-(2-ethoxyphenyl)prop-2-enoate Traditional Name: (E)-3-o-phenetylacrylic acid [(1R)-2-(cycloheptylamino)-2-keto-1-methyl-ethyl] ester Formula: C21H29NO4 MolecularWeight: 359.45926

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C=CC(=O)OC(C)C(=O)NC2CCCCCC2

Isomeric SMILES

CCOC1=CC=CC=C1/C=C/C(=O)O[C@H](C)C(=O)NC2CCCCCC2

InChI

InChI=1S/C21H29NO4/c1-3-25-19-13-9-8-10-17(19)14-15-20(23)26-16(2)21(24)22-18-11-6-4-5-7-12-18/h8-10,13-16,18H,3-7,11-12H2,1-2H3,(H,22,24)/b15-14+/t16-/m1/s1