2-hydroxyethyl (E)-2-tert-butyl-3-[1-phenylethyl(prop-2-enyl)amino]hex-4-enoate

Systemtic Name: 2-hydroxyethyl (E)-2-tert-butyl-3-[1-phenylethyl(prop-2-enyl)amino]hex-4-enoate Openeye Name: 2-hydroxyethyl (E)-3-[allyl(1-phenylethyl)amino]-2-tert-butyl-hex-4-enoate CAS Name: (E)-2-tert-butyl-3-[1-phenylethyl(prop-2-enyl)amino]-4-hexenoic acid 2-hydroxyethyl ester IUPAC Name: 2-hydroxyethyl (E)-2-tert-butyl-3-[1-phenylethyl(prop-2-enyl)amino]hex-4-enoate Traditional Name: (E)-3-[allyl(1-phenylethyl)amino]-2-tert-butyl-hex-4-enoic acid 2-hydroxyethyl ester Formula: C23H35NO3 MolecularWeight: 373.5289

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC=CC(C(C(=O)OCCO)C(C)(C)C)N(CC=C)C(C)C1=CC=CC=C1

Isomeric SMILES

C/C=C/C(C(C(=O)OCCO)C(C)(C)C)N(CC=C)C(C)C1=CC=CC=C1

InChI

InChI=1S/C23H35NO3/c1-7-12-20(21(23(4,5)6)22(26)27-17-16-25)24(15-8-2)18(3)19-13-10-9-11-14-19/h7-14,18,20-21,25H,2,15-17H2,1,3-6H3/b12-7+