methyl (2E,3R)-2-ethylidene-5-phenylmethoxy-3-[(phenylmethyl)amino]pentanoate

Systemtic Name: methyl (2E,3R)-2-ethylidene-5-phenylmethoxy-3-[(phenylmethyl)amino]pentanoate Openeye Name: methyl (2E,3R)-3-(benzylamino)-5-benzyloxy-2-ethylidene-pentanoate CAS Name: (2E,3R)-2-ethylidene-5-phenylmethoxy-3-[(phenylmethyl)amino]pentanoic acid methyl ester IUPAC Name: methyl (2E,3R)-3-(benzylamino)-2-ethylidene-5-phenylmethoxypentanoate Traditional Name: (E)-2-[(1R)-3-benzoxy-1-(benzylamino)propyl]but-2-enoic acid methyl ester Formula: C22H27NO3 MolecularWeight: 353.45468

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Descriptors Computed from Structure

Canonical SMILES:

CC=C(C(CCOCC1=CC=CC=C1)NCC2=CC=CC=C2)C(=O)OC

Isomeric SMILES

C/C=C(\[C@@H](CCOCC1=CC=CC=C1)NCC2=CC=CC=C2)/C(=O)OC

InChI

InChI=1S/C22H27NO3/c1-3-20(22(24)25-2)21(23-16-18-10-6-4-7-11-18)14-15-26-17-19-12-8-5-9-13-19/h3-13,21,23H,14-17H2,1-2H3/b20-3+/t21-/m1/s1