methyl (E)-6-methyl-4-[[(2S)-1-(methylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]carbamoyl]hept-3-enoate

Systemtic Name: methyl (E)-6-methyl-4-[[(2S)-1-(methylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]carbamoyl]hept-3-enoate Openeye Name: methyl (E)-4-[[(1S)-1-benzyl-2-(methylamino)-2-oxo-ethyl]carbamoyl]-6-methyl-hept-3-enoate CAS Name: (E)-6-methyl-4-[[[(2S)-1-(methylamino)-1-oxo-3-phenylpropan-2-yl]amino]-oxomethyl]-3-heptenoic acid methyl ester IUPAC Name: methyl (E)-6-methyl-4-[[(2S)-1-(methylamino)-1-oxo-3-phenylpropan-2-yl]carbamoyl]hept-3-enoate Traditional Name: (E)-4-[[(1S)-1-benzyl-2-keto-2-(methylamino)ethyl]carbamoyl]-6-methyl-hept-3-enoic acid methyl ester Formula: C20H28N2O4 MolecularWeight: 360.44732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=CCC(=O)OC)C(=O)NC(CC1=CC=CC=C1)C(=O)NC

Isomeric SMILES

CC(C)C/C(=C\CC(=O)OC)/C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NC

InChI

InChI=1S/C20H28N2O4/c1-14(2)12-16(10-11-18(23)26-4)19(24)22-17(20(25)21-3)13-15-8-6-5-7-9-15/h5-10,14,17H,11-13H2,1-4H3,(H,21,25)(H,22,24)/b16-10+/t17-/m0/s1