[1-(tert-butylamino)-1-oxidanylidene-propan-2-yl] (E)-3-(3-ethoxy-4-propoxy-phenyl)prop-2-enoate

Systemtic Name: [1-(tert-butylamino)-1-oxidanylidene-propan-2-yl] (E)-3-(3-ethoxy-4-propoxy-phenyl)prop-2-enoate Openeye Name: [2-(tert-butylamino)-1-methyl-2-oxo-ethyl] (E)-3-(3-ethoxy-4-propoxy-phenyl)prop-2-enoate CAS Name: (E)-3-(3-ethoxy-4-propoxyphenyl)-2-propenoic acid [1-(tert-butylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(tert-butylamino)-1-oxopropan-2-yl] (E)-3-(3-ethoxy-4-propoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(3-ethoxy-4-propoxy-phenyl)acrylic acid [2-(tert-butylamino)-2-keto-1-methyl-ethyl] ester Formula: C21H31NO5 MolecularWeight: 377.47454

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C=CC(=O)OC(C)C(=O)NC(C)(C)C)OCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)/C=C/C(=O)OC(C)C(=O)NC(C)(C)C)OCC

InChI

InChI=1S/C21H31NO5/c1-7-13-26-17-11-9-16(14-18(17)25-8-2)10-12-19(23)27-15(3)20(24)22-21(4,5)6/h9-12,14-15H,7-8,13H2,1-6H3,(H,22,24)/b12-10+