ethyl (E,4S)-4-[[(2S)-2-benzamido-3,3-dimethyl-butanoyl]-methyl-amino]-2,5-dimethyl-hex-2-enoate

Systemtic Name: ethyl (E,4S)-4-[[(2S)-2-benzamido-3,3-dimethyl-butanoyl]-methyl-amino]-2,5-dimethyl-hex-2-enoate Openeye Name: ethyl (E,4S)-4-[[(2S)-2-benzamido-3,3-dimethyl-butanoyl]-methyl-amino]-2,5-dimethyl-hex-2-enoate CAS Name: (E,4S)-4-[[(2S)-2-benzamido-3,3-dimethyl-1-oxobutyl]-methylamino]-2,5-dimethyl-2-hexenoic acid ethyl ester IUPAC Name: ethyl (E,4S)-4-[[(2S)-2-benzamido-3,3-dimethylbutanoyl]-methylamino]-2,5-dimethylhex-2-enoate Traditional Name: (E,4S)-4-[[(2S)-2-benzamido-3,3-dimethyl-butanoyl]-methyl-amino]-2,5-dimethyl-hex-2-enoic acid ethyl ester Formula: C24H36N2O4 MolecularWeight: 416.55364

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC(C(C)C)N(C)C(=O)C(C(C)(C)C)NC(=O)C1=CC=CC=C1)C

Isomeric SMILES

CCOC(=O)/C(=C/[C@H](C(C)C)N(C)C(=O)[C@H](C(C)(C)C)NC(=O)C1=CC=CC=C1)/C

InChI

InChI=1S/C24H36N2O4/c1-9-30-23(29)17(4)15-19(16(2)3)26(8)22(28)20(24(5,6)7)25-21(27)18-13-11-10-12-14-18/h10-16,19-20H,9H2,1-8H3,(H,25,27)/b17-15+/t19-,20-/m1/s1