tert-butyl (2S)-4-methyl-2-[[4-[3-(oxidanylamino)-3-oxidanylidene-propyl]phenyl]methylamino]pentanoate

Systemtic Name: tert-butyl (2S)-4-methyl-2-[[4-[3-(oxidanylamino)-3-oxidanylidene-propyl]phenyl]methylamino]pentanoate Openeye Name: tert-butyl (2S)-2-[[4-[3-(hydroxyamino)-3-oxo-propyl]phenyl]methylamino]-4-methyl-pentanoate CAS Name: (2S)-2-[[4-[3-(hydroxyamino)-3-oxopropyl]phenyl]methylamino]-4-methylpentanoic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-[[4-[3-(hydroxyamino)-3-oxopropyl]phenyl]methylamino]-4-methylpentanoate Traditional Name: (2S)-2-[[4-[3-(hydroxyamino)-3-keto-propyl]benzyl]amino]-4-methyl-valeric acid tert-butyl ester Formula: C20H32N2O4 MolecularWeight: 364.47908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC(C)(C)C)NCC1=CC=C(C=C1)CCC(=O)NO

Isomeric SMILES

CC(C)C[C@@H](C(=O)OC(C)(C)C)NCC1=CC=C(C=C1)CCC(=O)NO

InChI

InChI=1S/C20H32N2O4/c1-14(2)12-17(19(24)26-20(3,4)5)21-13-16-8-6-15(7-9-16)10-11-18(23)22-25/h6-9,14,17,21,25H,10-13H2,1-5H3,(H,22,23)/t17-/m0/s1