(2S)-2-[2-[(4-chlorophenyl)methylamino]-2-oxidanylidene-ethyl]pent-4-enoic acid

Systemtic Name: (2S)-2-[2-[(4-chlorophenyl)methylamino]-2-oxidanylidene-ethyl]pent-4-enoic acid Openeye Name: (2S)-2-[2-[(4-chlorophenyl)methylamino]-2-oxo-ethyl]pent-4-enoic acid CAS Name: (2S)-2-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]-4-pentenoic acid IUPAC Name: (2S)-2-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]pent-4-enoic acid Traditional Name: (2S)-2-[2-[(4-chlorobenzyl)amino]-2-keto-ethyl]pent-4-enoic acid Formula: C14H16ClNO3 MolecularWeight: 281.73474

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC(CC(=O)NCC1=CC=C(C=C1)Cl)C(=O)O

Isomeric SMILES

C=CC[C@@H](CC(=O)NCC1=CC=C(C=C1)Cl)C(=O)O

InChI

InChI=1S/C14H16ClNO3/c1-2-3-11(14(18)19)8-13(17)16-9-10-4-6-12(15)7-5-10/h2,4-7,11H,1,3,8-9H2,(H,16,17)(H,18,19)/t11-/m0/s1