(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxidanylidene-5-(9H-xanthen-9-ylamino)pentanoate

Systemtic Name: (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxidanylidene-5-(9H-xanthen-9-ylamino)pentanoate Openeye Name: (2S)-2-(tert-butoxycarbonylamino)-5-oxo-5-(9H-xanthen-9-ylamino)pentanoate CAS Name: (2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-5-oxo-5-(9H-xanthen-9-ylamino)pentanoate IUPAC Name: (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxo-5-(9H-xanthen-9-ylamino)pentanoate Traditional Name: (2S)-2-(tert-butoxycarbonylamino)-5-keto-5-(9H-xanthen-9-ylamino)valerate Formula: C23H25N2O6- MolecularWeight: 425.4544

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CCC(=O)NC1C2=CC=CC=C2OC3=CC=CC=C13)C(=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CCC(=O)NC1C2=CC=CC=C2OC3=CC=CC=C13)C(=O)[O-]

InChI

InChI=1S/C23H26N2O6/c1-23(2,3)31-22(29)24-16(21(27)28)12-13-19(26)25-20-14-8-4-6-10-17(14)30-18-11-7-5-9-15(18)20/h4-11,16,20H,12-13H2,1-3H3,(H,24,29)(H,25,26)(H,27,28)/p-1/t16-/m0/s1