methyl (2S)-2-[[1-(2-methoxyphenyl)-5-methyl-3-oxidanylidene-hex-4-enyl]amino]-3-methyl-butanoate

Systemtic Name: methyl (2S)-2-[[1-(2-methoxyphenyl)-5-methyl-3-oxidanylidene-hex-4-enyl]amino]-3-methyl-butanoate Openeye Name: methyl (2S)-2-[[1-(2-methoxyphenyl)-5-methyl-3-oxo-hex-4-enyl]amino]-3-methyl-butanoate CAS Name: (2S)-2-[[1-(2-methoxyphenyl)-5-methyl-3-oxohex-4-enyl]amino]-3-methylbutanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[1-(2-methoxyphenyl)-5-methyl-3-oxohex-4-enyl]amino]-3-methylbutanoate Traditional Name: (2S)-2-[[3-keto-1-(2-methoxyphenyl)-5-methyl-hex-4-enyl]amino]-3-methyl-butyric acid methyl ester Formula: C20H29NO4 MolecularWeight: 347.44856

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC)NC(CC(=O)C=C(C)C)C1=CC=CC=C1OC

Isomeric SMILES

CC(C)[C@@H](C(=O)OC)NC(CC(=O)C=C(C)C)C1=CC=CC=C1OC

InChI

InChI=1S/C20H29NO4/c1-13(2)11-15(22)12-17(16-9-7-8-10-18(16)24-5)21-19(14(3)4)20(23)25-6/h7-11,14,17,19,21H,12H2,1-6H3/t17?,19-/m0/s1