ethyl (E,4S)-4-[(2-chloranyl-2-phenyl-ethanoyl)amino]-5-methyl-hex-2-enoate

Systemtic Name: ethyl (E,4S)-4-[(2-chloranyl-2-phenyl-ethanoyl)amino]-5-methyl-hex-2-enoate Openeye Name: ethyl (E,4S)-4-[(2-chloro-2-phenyl-acetyl)amino]-5-methyl-hex-2-enoate CAS Name: (E,4S)-4-[(2-chloro-1-oxo-2-phenylethyl)amino]-5-methyl-2-hexenoic acid ethyl ester IUPAC Name: ethyl (E,4S)-4-[(2-chloro-2-phenylacetyl)amino]-5-methylhex-2-enoate Traditional Name: (E,4S)-4-[(2-chloro-2-phenyl-acetyl)amino]-5-methyl-hex-2-enoic acid ethyl ester Formula: C17H22ClNO3 MolecularWeight: 323.81448

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC(C(C)C)NC(=O)C(C1=CC=CC=C1)Cl

Isomeric SMILES

CCOC(=O)/C=C/[C@H](C(C)C)NC(=O)C(C1=CC=CC=C1)Cl

InChI

InChI=1S/C17H22ClNO3/c1-4-22-15(20)11-10-14(12(2)3)19-17(21)16(18)13-8-6-5-7-9-13/h5-12,14,16H,4H2,1-3H3,(H,19,21)/b11-10+/t14-,16?/m1/s1