(2R)-2-[2-[2-hydroxyethyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]pent-4-enoic acid

Systemtic Name: (2R)-2-[2-[2-hydroxyethyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]pent-4-enoic acid Openeye Name: (2R)-2-[2-[benzyl(2-hydroxyethyl)amino]-2-oxo-ethyl]pent-4-enoic acid CAS Name: (2R)-2-[2-[2-hydroxyethyl-(phenylmethyl)amino]-2-oxoethyl]-4-pentenoic acid IUPAC Name: (2R)-2-[2-[benzyl(2-hydroxyethyl)amino]-2-oxoethyl]pent-4-enoic acid Traditional Name: (2R)-2-[2-[benzyl(2-hydroxyethyl)amino]-2-keto-ethyl]pent-4-enoic acid Formula: C16H21NO4 MolecularWeight: 291.34224

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC(CC(=O)N(CCO)CC1=CC=CC=C1)C(=O)O

Isomeric SMILES

C=CC[C@H](CC(=O)N(CCO)CC1=CC=CC=C1)C(=O)O

InChI

InChI=1S/C16H21NO4/c1-2-6-14(16(20)21)11-15(19)17(9-10-18)12-13-7-4-3-5-8-13/h2-5,7-8,14,18H,1,6,9-12H2,(H,20,21)/t14-/m1/s1