(2R)-2-(acridin-10-ium-9-ylamino)-5-[(2-methylpropan-2-yl)oxy]-5-oxidanylidene-pentanoate

Systemtic Name: (2R)-2-(acridin-10-ium-9-ylamino)-5-[(2-methylpropan-2-yl)oxy]-5-oxidanylidene-pentanoate Openeye Name: (2R)-2-(acridin-10-ium-9-ylamino)-5-tert-butoxy-5-oxo-pentanoate CAS Name: (2R)-2-(9-acridin-10-iumylamino)-5-[(2-methylpropan-2-yl)oxy]-5-oxopentanoate IUPAC Name: (2R)-2-(acridin-10-ium-9-ylamino)-5-[(2-methylpropan-2-yl)oxy]-5-oxopentanoate Traditional Name: (2R)-2-(acridin-10-ium-9-ylamino)-5-tert-butoxy-5-keto-valerate Formula: C22H24N2O4 MolecularWeight: 380.43696

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CCC(C(=O)[O-])NC1=C2C=CC=CC2=[NH+]C3=CC=CC=C31

Isomeric SMILES

CC(C)(C)OC(=O)CC[C@H](C(=O)[O-])NC1=C2C=CC=CC2=[NH+]C3=CC=CC=C31

InChI

InChI=1S/C22H24N2O4/c1-22(2,3)28-19(25)13-12-18(21(26)27)24-20-14-8-4-6-10-16(14)23-17-11-7-5-9-15(17)20/h4-11,18H,12-13H2,1-3H3,(H,23,24)(H,26,27)/t18-/m1/s1