1-adamantylmethyl-[(3R)-1-(2,6-dimethylphenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]azanium

Systemtic Name: 1-adamantylmethyl-[(3R)-1-(2,6-dimethylphenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]azanium Openeye Name: 1-adamantylmethyl-[(3R)-1-(2,6-dimethylphenyl)-2,5-dioxo-pyrrolidin-3-yl]ammonium CAS Name: 1-adamantylmethyl-[(3R)-1-(2,6-dimethylphenyl)-2,5-dioxo-3-pyrrolidinyl]ammonium IUPAC Name: 1-adamantylmethyl-[(3R)-1-(2,6-dimethylphenyl)-2,5-dioxopyrrolidin-3-yl]azanium Traditional Name: 1-adamantylmethyl-[(3R)-1-(2,6-dimethylphenyl)-2,5-diketo-pyrrolidin-3-yl]ammonium Formula: C23H31N2O2+ MolecularWeight: 367.50444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N2C(=O)CC(C2=O)[NH2+]CC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC1=C(C(=CC=C1)C)N2C(=O)C[C@H](C2=O)[NH2+]CC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C23H30N2O2/c1-14-4-3-5-15(2)21(14)25-20(26)9-19(22(25)27)24-13-23-10-16-6-17(11-23)8-18(7-16)12-23/h3-5,16-19,24H,6-13H2,1-2H3/p+1/t16?,17?,18?,19-,23?/m1/s1