(2S)-4-methyl-2-[[(2S)-2-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)-3-phenyl-propanoyl]amino]pentanoate

Systemtic Name: (2S)-4-methyl-2-[[(2S)-2-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)-3-phenyl-propanoyl]amino]pentanoate Openeye Name: (2S)-4-methyl-2-[[(2S)-2-(4-oxo-1,2,3-benzotriazin-3-yl)-3-phenyl-propanoyl]amino]pentanoate CAS Name: (2S)-4-methyl-2-[[(2S)-1-oxo-2-(4-oxo-1,2,3-benzotriazin-3-yl)-3-phenylpropyl]amino]pentanoate IUPAC Name: (2S)-4-methyl-2-[[(2S)-2-(4-oxo-1,2,3-benzotriazin-3-yl)-3-phenylpropanoyl]amino]pentanoate Traditional Name: (2S)-2-[[(2S)-2-(4-keto-1,2,3-benzotriazin-3-yl)-3-phenyl-propanoyl]amino]-4-methyl-valerate Formula: C22H23N4O4- MolecularWeight: 407.44242

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)[O-])NC(=O)C(CC1=CC=CC=C1)N2C(=O)C3=CC=CC=C3N=N2

Isomeric SMILES

CC(C)C[C@@H](C(=O)[O-])NC(=O)[C@H](CC1=CC=CC=C1)N2C(=O)C3=CC=CC=C3N=N2

InChI

InChI=1S/C22H24N4O4/c1-14(2)12-18(22(29)30)23-20(27)19(13-15-8-4-3-5-9-15)26-21(28)16-10-6-7-11-17(16)24-25-26/h3-11,14,18-19H,12-13H2,1-2H3,(H,23,27)(H,29,30)/p-1/t18-,19-/m0/s1