tert-butyl (E)-2-[3-methylbutanoyl-(2-methylpropylamino)amino]-5-phenyl-pent-4-enoate

Systemtic Name: tert-butyl (E)-2-[3-methylbutanoyl-(2-methylpropylamino)amino]-5-phenyl-pent-4-enoate Openeye Name: tert-butyl (E)-2-[(isobutylamino)-(3-methylbutanoyl)amino]-5-phenyl-pent-4-enoate CAS Name: (E)-2-[(3-methyl-1-oxobutyl)-(2-methylpropylamino)amino]-5-phenyl-4-pentenoic acid tert-butyl ester IUPAC Name: tert-butyl (E)-2-[3-methylbutanoyl-(2-methylpropylamino)amino]-5-phenylpent-4-enoate Traditional Name: (E)-2-[(isobutylamino)-isovaleryl-amino]-5-phenyl-pent-4-enoic acid tert-butyl ester Formula: C24H38N2O3 MolecularWeight: 402.57012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N(C(CC=CC1=CC=CC=C1)C(=O)OC(C)(C)C)NCC(C)C

Isomeric SMILES

CC(C)CC(=O)N(C(C/C=C/C1=CC=CC=C1)C(=O)OC(C)(C)C)NCC(C)C

InChI

InChI=1S/C24H38N2O3/c1-18(2)16-22(27)26(25-17-19(3)4)21(23(28)29-24(5,6)7)15-11-14-20-12-9-8-10-13-20/h8-14,18-19,21,25H,15-17H2,1-7H3/b14-11+