1-adamantylmethyl-[(3R)-1-(4-bromophenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]azanium

Systemtic Name: 1-adamantylmethyl-[(3R)-1-(4-bromophenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]azanium Openeye Name: 1-adamantylmethyl-[(3R)-1-(4-bromophenyl)-2,5-dioxo-pyrrolidin-3-yl]ammonium CAS Name: 1-adamantylmethyl-[(3R)-1-(4-bromophenyl)-2,5-dioxo-3-pyrrolidinyl]ammonium IUPAC Name: 1-adamantylmethyl-[(3R)-1-(4-bromophenyl)-2,5-dioxopyrrolidin-3-yl]azanium Traditional Name: 1-adamantylmethyl-[(3R)-1-(4-bromophenyl)-2,5-diketo-pyrrolidin-3-yl]ammonium Formula: C21H26BrN2O2+ MolecularWeight: 418.34734

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C[NH2+]C4CC(=O)N(C4=O)C5=CC=C(C=C5)Br

Isomeric SMILES

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

InChI

InChI=1S/C21H25BrN2O2/c22-16-1-3-17(4-2-16)24-19(25)8-18(20(24)26)23-12-21-9-13-5-14(10-21)7-15(6-13)11-21/h1-4,13-15,18,23H,5-12H2/p+1/t13?,14?,15?,18-,21?/m1/s1