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

Systemtic Name: methyl (E)-4-[[(2S)-1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl]carbamoyl]-6-methyl-hept-3-enoate Openeye Name: methyl (E)-4-[[(1S)-2-amino-1-benzyl-2-oxo-ethyl]carbamoyl]-6-methyl-hept-3-enoate CAS Name: (E)-4-[[[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]amino]-oxomethyl]-6-methyl-3-heptenoic acid methyl ester IUPAC Name: methyl (E)-4-[[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]carbamoyl]-6-methylhept-3-enoate Traditional Name: (E)-4-[[(1S)-2-amino-1-benzyl-2-keto-ethyl]carbamoyl]-6-methyl-hept-3-enoic acid methyl ester Formula: C19H26N2O4 MolecularWeight: 346.42074

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H26N2O4/c1-13(2)11-15(9-10-17(22)25-3)19(24)21-16(18(20)23)12-14-7-5-4-6-8-14/h4-9,13,16H,10-12H2,1-3H3,(H2,20,23)(H,21,24)/b15-9+/t16-/m0/s1