tert-butyl (3S,4R)-3-[[(2S)-4-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]-2-oxidanylidene-4-propan-2-yl-azetidine-1-carboxylate

Systemtic Name: tert-butyl (3S,4R)-3-[[(2S)-4-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]-2-oxidanylidene-4-propan-2-yl-azetidine-1-carboxylate Openeye Name: tert-butyl (2R,3S)-3-[[(2S)-2-(benzyloxycarbonylamino)-4-methyl-pentanoyl]amino]-2-isopropyl-4-oxo-azetidine-1-carboxylate CAS Name: (3S,4R)-3-[[(2S)-4-methyl-1-oxo-2-(phenylmethoxycarbonylamino)pentyl]amino]-2-oxo-4-propan-2-yl-1-azetidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (3S,4R)-3-[[(2S)-4-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]-2-oxo-4-propan-2-ylazetidine-1-carboxylate Traditional Name: (2R,3S)-3-[[(2S)-2-(benzyloxycarbonylamino)-4-methyl-pentanoyl]amino]-2-isopropyl-4-keto-azetidine-1-carboxylic acid tert-butyl ester Formula: C25H37N3O6 MolecularWeight: 475.57778

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC1C(N(C1=O)C(=O)OC(C)(C)C)C(C)C)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)C[C@@H](C(=O)N[C@H]1[C@H](N(C1=O)C(=O)OC(C)(C)C)C(C)C)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C25H37N3O6/c1-15(2)13-18(26-23(31)33-14-17-11-9-8-10-12-17)21(29)27-19-20(16(3)4)28(22(19)30)24(32)34-25(5,6)7/h8-12,15-16,18-20H,13-14H2,1-7H3,(H,26,31)(H,27,29)/t18-,19-,20+/m0/s1