ethyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonyl-(phenylmethyl)amino]-3-phenyl-propanoate

Systemtic Name: ethyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonyl-(phenylmethyl)amino]-3-phenyl-propanoate Openeye Name: ethyl (2S)-2-[benzyl(tert-butoxycarbonyl)amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]-(phenylmethyl)amino]-3-phenylpropanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-[benzyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-3-phenylpropanoate Traditional Name: (2S)-2-[benzyl(tert-butoxycarbonyl)amino]-3-phenyl-propionic acid ethyl ester Formula: C23H29NO4 MolecularWeight: 383.48066

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=CC=C1)N(CC2=CC=CC=C2)C(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)[C@H](CC1=CC=CC=C1)N(CC2=CC=CC=C2)C(=O)OC(C)(C)C

InChI

InChI=1S/C23H29NO4/c1-5-27-21(25)20(16-18-12-8-6-9-13-18)24(22(26)28-23(2,3)4)17-19-14-10-7-11-15-19/h6-15,20H,5,16-17H2,1-4H3/t20-/m0/s1