tert-butyl (3R)-3-[[(2S)-1-(methylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]carbamoyl]-7-phenylmethoxy-heptanoate

Systemtic Name: tert-butyl (3R)-3-[[(2S)-1-(methylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]carbamoyl]-7-phenylmethoxy-heptanoate Openeye Name: tert-butyl (3R)-3-[[(1S)-1-benzyl-2-(methylamino)-2-oxo-ethyl]carbamoyl]-7-benzyloxy-heptanoate CAS Name: (3R)-3-[[[(2S)-1-(methylamino)-1-oxo-3-phenylpropan-2-yl]amino]-oxomethyl]-7-phenylmethoxyheptanoic acid tert-butyl ester IUPAC Name: tert-butyl (3R)-3-[[(2S)-1-(methylamino)-1-oxo-3-phenylpropan-2-yl]carbamoyl]-7-phenylmethoxyheptanoate Traditional Name: (3R)-7-benzoxy-3-[[(1S)-1-benzyl-2-keto-2-(methylamino)ethyl]carbamoyl]enanthic acid tert-butyl ester Formula: C29H40N2O5 MolecularWeight: 496.6383

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CC(CCCCOCC1=CC=CC=C1)C(=O)NC(CC2=CC=CC=C2)C(=O)NC

Isomeric SMILES

CC(C)(C)OC(=O)C[C@@H](CCCCOCC1=CC=CC=C1)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)NC

InChI

InChI=1S/C29H40N2O5/c1-29(2,3)36-26(32)20-24(17-11-12-18-35-21-23-15-9-6-10-16-23)27(33)31-25(28(34)30-4)19-22-13-7-5-8-14-22/h5-10,13-16,24-25H,11-12,17-21H2,1-4H3,(H,30,34)(H,31,33)/t24-,25+/m1/s1