tert-butyl (4S)-6-methyl-4-[[(2R)-3-methyl-1-phenylmethoxy-butan-2-yl]-oxidanyl-amino]hept-2-ynoate

Systemtic Name: tert-butyl (4S)-6-methyl-4-[[(2R)-3-methyl-1-phenylmethoxy-butan-2-yl]-oxidanyl-amino]hept-2-ynoate Openeye Name: tert-butyl (4S)-4-[[(1R)-1-(benzyloxymethyl)-2-methyl-propyl]-hydroxy-amino]-6-methyl-hept-2-ynoate CAS Name: (4S)-4-[hydroxy-[(2R)-3-methyl-1-phenylmethoxybutan-2-yl]amino]-6-methyl-2-heptynoic acid tert-butyl ester IUPAC Name: tert-butyl (4S)-4-[hydroxy-[(2R)-3-methyl-1-phenylmethoxybutan-2-yl]amino]-6-methylhept-2-ynoate Traditional Name: (4S)-4-[[(1R)-1-(benzoxymethyl)-2-methyl-propyl]-hydroxy-amino]-6-methyl-hept-2-ynoic acid tert-butyl ester Formula: C24H37NO4 MolecularWeight: 403.55488

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C#CC(=O)OC(C)(C)C)N(C(COCC1=CC=CC=C1)C(C)C)O

Isomeric SMILES

CC(C)C[C@@H](C#CC(=O)OC(C)(C)C)N([C@@H](COCC1=CC=CC=C1)C(C)C)O

InChI

InChI=1S/C24H37NO4/c1-18(2)15-21(13-14-23(26)29-24(5,6)7)25(27)22(19(3)4)17-28-16-20-11-9-8-10-12-20/h8-12,18-19,21-22,27H,15-17H2,1-7H3/t21-,22+/m1/s1