ethyl (E,4S)-5-oxidanyl-4-[(phenylmethyl)amino]pent-2-enoate

Systemtic Name: ethyl (E,4S)-5-oxidanyl-4-[(phenylmethyl)amino]pent-2-enoate Openeye Name: ethyl (E,4S)-4-(benzylamino)-5-hydroxy-pent-2-enoate CAS Name: (E,4S)-5-hydroxy-4-[(phenylmethyl)amino]-2-pentenoic acid ethyl ester IUPAC Name: ethyl (E,4S)-4-(benzylamino)-5-hydroxypent-2-enoate Traditional Name: (E,4S)-4-(benzylamino)-5-hydroxy-pent-2-enoic acid ethyl ester Formula: C14H19NO3 MolecularWeight: 249.30556

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC(CO)NCC1=CC=CC=C1

Isomeric SMILES

CCOC(=O)/C=C/[C@@H](CO)NCC1=CC=CC=C1

InChI

InChI=1S/C14H19NO3/c1-2-18-14(17)9-8-13(11-16)15-10-12-6-4-3-5-7-12/h3-9,13,15-16H,2,10-11H2,1H3/b9-8+/t13-/m0/s1