[(2S)-1-oxidanylidene-1-(propylamino)propan-2-yl] (E)-3-(3-chloranyl-5-ethoxy-4-methoxy-phenyl)prop-2-enoate

Systemtic Name: [(2S)-1-oxidanylidene-1-(propylamino)propan-2-yl] (E)-3-(3-chloranyl-5-ethoxy-4-methoxy-phenyl)prop-2-enoate Openeye Name: [(1S)-1-methyl-2-oxo-2-(propylamino)ethyl] (E)-3-(3-chloro-5-ethoxy-4-methoxy-phenyl)prop-2-enoate CAS Name: (E)-3-(3-chloro-5-ethoxy-4-methoxyphenyl)-2-propenoic acid [(2S)-1-oxo-1-(propylamino)propan-2-yl] ester IUPAC Name: [(2S)-1-oxo-1-(propylamino)propan-2-yl] (E)-3-(3-chloro-5-ethoxy-4-methoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(3-chloro-5-ethoxy-4-methoxy-phenyl)acrylic acid [(1S)-2-keto-1-methyl-2-(propylamino)ethyl] ester Formula: C18H24ClNO5 MolecularWeight: 369.83986

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)OC(=O)C=CC1=CC(=C(C(=C1)Cl)OC)OCC

Isomeric SMILES

CCCNC(=O)[C@H](C)OC(=O)/C=C/C1=CC(=C(C(=C1)Cl)OC)OCC

InChI

InChI=1S/C18H24ClNO5/c1-5-9-20-18(22)12(3)25-16(21)8-7-13-10-14(19)17(23-4)15(11-13)24-6-2/h7-8,10-12H,5-6,9H2,1-4H3,(H,20,22)/b8-7+/t12-/m0/s1