methyl (3S)-3-[[(2S)-2-azanyl-3-(1H-imidazol-5-yl)propanoyl]amino]-5-methyl-2-oxidanyl-hexanoate

Systemtic Name: methyl (3S)-3-[[(2S)-2-azanyl-3-(1H-imidazol-5-yl)propanoyl]amino]-5-methyl-2-oxidanyl-hexanoate Openeye Name: methyl (3S)-3-[[(2S)-2-amino-3-(1H-imidazol-5-yl)propanoyl]amino]-2-hydroxy-5-methyl-hexanoate CAS Name: (3S)-3-[[(2S)-2-amino-3-(1H-imidazol-5-yl)-1-oxopropyl]amino]-2-hydroxy-5-methylhexanoic acid methyl ester IUPAC Name: methyl (3S)-3-[[(2S)-2-amino-3-(1H-imidazol-5-yl)propanoyl]amino]-2-hydroxy-5-methylhexanoate Traditional Name: (3S)-3-[[(2S)-2-amino-3-(1H-imidazol-5-yl)propanoyl]amino]-2-hydroxy-5-methyl-hexanoic acid methyl ester Formula: C14H24N4O4 MolecularWeight: 312.36476

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(C(=O)OC)O)NC(=O)C(CC1=CN=CN1)N

Isomeric SMILES

CC(C)C[C@@H](C(C(=O)OC)O)NC(=O)[C@H](CC1=CN=CN1)N

InChI

InChI=1S/C14H24N4O4/c1-8(2)4-11(12(19)14(21)22-3)18-13(20)10(15)5-9-6-16-7-17-9/h6-8,10-12,19H,4-5,15H2,1-3H3,(H,16,17)(H,18,20)/t10-,11-,12?/m0/s1