[2-(butan-2-ylamino)-2-oxidanylidene-ethyl] (E)-3-(3-chloranyl-4,5-dimethoxy-phenyl)prop-2-enoate

Systemtic Name: [2-(butan-2-ylamino)-2-oxidanylidene-ethyl] (E)-3-(3-chloranyl-4,5-dimethoxy-phenyl)prop-2-enoate Openeye Name: [2-oxo-2-(sec-butylamino)ethyl] (E)-3-(3-chloro-4,5-dimethoxy-phenyl)prop-2-enoate CAS Name: (E)-3-(3-chloro-4,5-dimethoxyphenyl)-2-propenoic acid [2-(butan-2-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(butan-2-ylamino)-2-oxoethyl] (E)-3-(3-chloro-4,5-dimethoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(3-chloro-4,5-dimethoxy-phenyl)acrylic acid [2-keto-2-(sec-butylamino)ethyl] ester Formula: C17H22ClNO5 MolecularWeight: 355.81328

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)COC(=O)C=CC1=CC(=C(C(=C1)Cl)OC)OC

Isomeric SMILES

CCC(C)NC(=O)COC(=O)/C=C/C1=CC(=C(C(=C1)Cl)OC)OC

InChI

InChI=1S/C17H22ClNO5/c1-5-11(2)19-15(20)10-24-16(21)7-6-12-8-13(18)17(23-4)14(9-12)22-3/h6-9,11H,5,10H2,1-4H3,(H,19,20)/b7-6+