ethyl 2-[methyl-[(2R)-3-[(3-methylphenyl)methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-2-(phenylmethoxycarbonylamino)propyl]amino]ethanoate

Systemtic Name: ethyl 2-[methyl-[(2R)-3-[(3-methylphenyl)methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-2-(phenylmethoxycarbonylamino)propyl]amino]ethanoate Openeye Name: ethyl 2-[[(2R)-2-(benzyloxycarbonylamino)-3-[tert-butoxycarbonyl(m-tolylmethyl)amino]propyl]-methyl-amino]acetate CAS Name: 2-[methyl-[(2R)-3-[(3-methylphenyl)methyl-[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-(phenylmethoxycarbonylamino)propyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[methyl-[(2R)-3-[(3-methylphenyl)methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-2-(phenylmethoxycarbonylamino)propyl]amino]acetate Traditional Name: 2-[[(2R)-2-(benzyloxycarbonylamino)-3-[tert-butoxycarbonyl-(3-methylbenzyl)amino]propyl]-methyl-amino]acetic acid ethyl ester Formula: C29H41N3O6 MolecularWeight: 527.65234

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(C)CC(CN(CC1=CC=CC(=C1)C)C(=O)OC(C)(C)C)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)CN(C)C[C@H](CN(CC1=CC=CC(=C1)C)C(=O)OC(C)(C)C)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C29H41N3O6/c1-7-36-26(33)20-31(6)18-25(30-27(34)37-21-23-13-9-8-10-14-23)19-32(28(35)38-29(3,4)5)17-24-15-11-12-22(2)16-24/h8-16,25H,7,17-21H2,1-6H3,(H,30,34)/t25-/m1/s1