prop-2-enyl (2S,3R)-3-methanoyl-2-[(4-methoxyphenyl)amino]-4-methyl-pentanoate

Systemtic Name: prop-2-enyl (2S,3R)-3-methanoyl-2-[(4-methoxyphenyl)amino]-4-methyl-pentanoate Openeye Name: allyl (2S,3R)-3-formyl-2-(4-methoxyanilino)-4-methyl-pentanoate CAS Name: (2S,3R)-3-formyl-2-(4-methoxyanilino)-4-methylpentanoic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (2S,3R)-3-formyl-2-(4-methoxyanilino)-4-methylpentanoate Traditional Name: (2S,3R)-3-formyl-4-methyl-2-(p-anisidino)valeric acid allyl ester Formula: C17H23NO4 MolecularWeight: 305.36882

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C=O)C(C(=O)OCC=C)NC1=CC=C(C=C1)OC

Isomeric SMILES

CC(C)[C@@H](C=O)[C@@H](C(=O)OCC=C)NC1=CC=C(C=C1)OC

InChI

InChI=1S/C17H23NO4/c1-5-10-22-17(20)16(15(11-19)12(2)3)18-13-6-8-14(21-4)9-7-13/h5-9,11-12,15-16,18H,1,10H2,2-4H3/t15-,16+/m1/s1