(3S)-5-chloranyl-3-[(2-methylpropan-2-yl)oxycarbonyl-(phenylmethyl)amino]-4-oxidanylidene-pentanoic acid

Systemtic Name: (3S)-5-chloranyl-3-[(2-methylpropan-2-yl)oxycarbonyl-(phenylmethyl)amino]-4-oxidanylidene-pentanoic acid Openeye Name: (3S)-3-[benzyl(tert-butoxycarbonyl)amino]-5-chloro-4-oxo-pentanoic acid CAS Name: (3S)-5-chloro-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]-(phenylmethyl)amino]-4-oxopentanoic acid IUPAC Name: (3S)-3-[benzyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-chloro-4-oxopentanoic acid Traditional Name: (3S)-3-[benzyl(tert-butoxycarbonyl)amino]-5-chloro-4-keto-valeric acid Formula: C17H22ClNO5 MolecularWeight: 355.81328

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(CC1=CC=CC=C1)C(CC(=O)O)C(=O)CCl

Isomeric SMILES

CC(C)(C)OC(=O)N(CC1=CC=CC=C1)[C@@H](CC(=O)O)C(=O)CCl

InChI

InChI=1S/C17H22ClNO5/c1-17(2,3)24-16(23)19(11-12-7-5-4-6-8-12)13(9-15(21)22)14(20)10-18/h4-8,13H,9-11H2,1-3H3,(H,21,22)/t13-/m0/s1