[2-oxidanylidene-2-(pentan-3-ylamino)ethyl] (E)-3-(3-chloranyl-4-methyl-phenyl)prop-2-enoate

Systemtic Name: [2-oxidanylidene-2-(pentan-3-ylamino)ethyl] (E)-3-(3-chloranyl-4-methyl-phenyl)prop-2-enoate Openeye Name: [2-(1-ethylpropylamino)-2-oxo-ethyl] (E)-3-(3-chloro-4-methyl-phenyl)prop-2-enoate CAS Name: (E)-3-(3-chloro-4-methylphenyl)-2-propenoic acid [2-oxo-2-(pentan-3-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(pentan-3-ylamino)ethyl] (E)-3-(3-chloro-4-methylphenyl)prop-2-enoate Traditional Name: (E)-3-(3-chloro-4-methyl-phenyl)acrylic acid [2-(1-ethylpropylamino)-2-keto-ethyl] ester Formula: C17H22ClNO3 MolecularWeight: 323.81448

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H22ClNO3/c1-4-14(5-2)19-16(20)11-22-17(21)9-8-13-7-6-12(3)15(18)10-13/h6-10,14H,4-5,11H2,1-3H3,(H,19,20)/b9-8+