phenyl (3R)-5-(cyclohexen-1-yl)-3-[(2-methoxyphenyl)amino]pent-4-ynoate

Systemtic Name: phenyl (3R)-5-(cyclohexen-1-yl)-3-[(2-methoxyphenyl)amino]pent-4-ynoate Openeye Name: phenyl (3R)-5-(cyclohexen-1-yl)-3-(2-methoxyanilino)pent-4-ynoate CAS Name: (3R)-5-(1-cyclohexenyl)-3-(2-methoxyanilino)-4-pentynoic acid phenyl ester IUPAC Name: phenyl (3R)-5-(cyclohexen-1-yl)-3-(2-methoxyanilino)pent-4-ynoate Traditional Name: (3R)-5-(cyclohexen-1-yl)-3-(o-anisidino)pent-4-ynoic acid phenyl ester Formula: C24H25NO3 MolecularWeight: 375.4602

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(CC(=O)OC2=CC=CC=C2)C#CC3=CCCCC3

Isomeric SMILES

COC1=CC=CC=C1N[C@H](CC(=O)OC2=CC=CC=C2)C#CC3=CCCCC3

InChI

InChI=1S/C24H25NO3/c1-27-23-15-9-8-14-22(23)25-20(17-16-19-10-4-2-5-11-19)18-24(26)28-21-12-6-3-7-13-21/h3,6-10,12-15,20,25H,2,4-5,11,18H2,1H3/t20-/m0/s1