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

Systemtic Name: 1-adamantylmethyl-[(3R)-1-(4-methoxyphenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]azanium Openeye Name: 1-adamantylmethyl-[(3R)-1-(4-methoxyphenyl)-2,5-dioxo-pyrrolidin-3-yl]ammonium CAS Name: 1-adamantylmethyl-[(3R)-1-(4-methoxyphenyl)-2,5-dioxo-3-pyrrolidinyl]ammonium IUPAC Name: 1-adamantylmethyl-[(3R)-1-(4-methoxyphenyl)-2,5-dioxopyrrolidin-3-yl]azanium Traditional Name: 1-adamantylmethyl-[(3R)-2,5-diketo-1-(4-methoxyphenyl)pyrrolidin-3-yl]ammonium Formula: C22H29N2O3+ MolecularWeight: 369.47726

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=O)CC(C2=O)[NH2+]CC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=O)C[C@H](C2=O)[NH2+]CC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C22H28N2O3/c1-27-18-4-2-17(3-5-18)24-20(25)9-19(21(24)26)23-13-22-10-14-6-15(11-22)8-16(7-14)12-22/h2-5,14-16,19,23H,6-13H2,1H3/p+1/t14?,15?,16?,19-,22?/m1/s1