tert-butyl 4-[(2S,3S)-3-ethyl-4-oxidanylidene-1-[[(1R)-1-phenylethyl]carbamoyl]-3-propyl-azetidin-2-yl]oxybenzoate

Systemtic Name: tert-butyl 4-[(2S,3S)-3-ethyl-4-oxidanylidene-1-[[(1R)-1-phenylethyl]carbamoyl]-3-propyl-azetidin-2-yl]oxybenzoate Openeye Name: tert-butyl 4-[(2S,3S)-3-ethyl-4-oxo-1-[[(1R)-1-phenylethyl]carbamoyl]-3-propyl-azetidin-2-yl]oxybenzoate CAS Name: 4-[[(2S,3S)-3-ethyl-4-oxo-1-[oxo-[[(1R)-1-phenylethyl]amino]methyl]-3-propyl-2-azetidinyl]oxy]benzoic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(2S,3S)-3-ethyl-4-oxo-1-[[(1R)-1-phenylethyl]carbamoyl]-3-propylazetidin-2-yl]oxybenzoate Traditional Name: 4-[(2S,3S)-3-ethyl-4-keto-1-[[(1R)-1-phenylethyl]carbamoyl]-3-propyl-azetidin-2-yl]oxybenzoic acid tert-butyl ester Formula: C28H36N2O5 MolecularWeight: 480.59584

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(C(N(C1=O)C(=O)NC(C)C2=CC=CC=C2)OC3=CC=C(C=C3)C(=O)OC(C)(C)C)CC

Isomeric SMILES

CCC[C@]1([C@@H](N(C1=O)C(=O)N[C@H](C)C2=CC=CC=C2)OC3=CC=C(C=C3)C(=O)OC(C)(C)C)CC

InChI

InChI=1S/C28H36N2O5/c1-7-18-28(8-2)24(32)30(26(33)29-19(3)20-12-10-9-11-13-20)25(28)34-22-16-14-21(15-17-22)23(31)35-27(4,5)6/h9-17,19,25H,7-8,18H2,1-6H3,(H,29,33)/t19-,25+,28-/m1/s1