ethyl (2S)-2-[[(3S)-1-[(2S)-1-methoxy-1-oxidanylidene-3-phenyl-propan-2-yl]-2-oxidanylidene-azepan-3-yl]amino]-4-phenyl-butanoate

Systemtic Name: ethyl (2S)-2-[[(3S)-1-[(2S)-1-methoxy-1-oxidanylidene-3-phenyl-propan-2-yl]-2-oxidanylidene-azepan-3-yl]amino]-4-phenyl-butanoate Openeye Name: ethyl (2S)-2-[[(3S)-1-[(1S)-1-benzyl-2-methoxy-2-oxo-ethyl]-2-oxo-azepan-3-yl]amino]-4-phenyl-butanoate CAS Name: (2S)-2-[[(3S)-1-[(2S)-1-methoxy-1-oxo-3-phenylpropan-2-yl]-2-oxo-3-azepanyl]amino]-4-phenylbutanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-[[(3S)-1-[(2S)-1-methoxy-1-oxo-3-phenylpropan-2-yl]-2-oxoazepan-3-yl]amino]-4-phenylbutanoate Traditional Name: (2S)-2-[[(3S)-1-[(1S)-1-benzyl-2-keto-2-methoxy-ethyl]-2-keto-azepan-3-yl]amino]-4-phenyl-butyric acid ethyl ester Formula: C28H36N2O5 MolecularWeight: 480.59584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC1=CC=CC=C1)NC2CCCCN(C2=O)C(CC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CCOC(=O)[C@H](CCC1=CC=CC=C1)N[C@H]2CCCCN(C2=O)[C@@H](CC3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C28H36N2O5/c1-3-35-27(32)24(18-17-21-12-6-4-7-13-21)29-23-16-10-11-19-30(26(23)31)25(28(33)34-2)20-22-14-8-5-9-15-22/h4-9,12-15,23-25,29H,3,10-11,16-20H2,1-2H3/t23-,24-,25-/m0/s1