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

Systemtic Name: 1-adamantyl-[(3R)-1-(4-methoxyphenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]azanium Openeye Name: 1-adamantyl-[(3R)-1-(4-methoxyphenyl)-2,5-dioxo-pyrrolidin-3-yl]ammonium CAS Name: 1-adamantyl-[(3R)-1-(4-methoxyphenyl)-2,5-dioxo-3-pyrrolidinyl]ammonium IUPAC Name: 1-adamantyl-[(3R)-1-(4-methoxyphenyl)-2,5-dioxopyrrolidin-3-yl]azanium Traditional Name: 1-adamantyl-[(3R)-2,5-diketo-1-(4-methoxyphenyl)pyrrolidin-3-yl]ammonium Formula: C21H27N2O3+ MolecularWeight: 355.45068

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=O)CC(C2=O)[NH2+]C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=O)C[C@H](C2=O)[NH2+]C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C21H26N2O3/c1-26-17-4-2-16(3-5-17)23-19(24)9-18(20(23)25)22-21-10-13-6-14(11-21)8-15(7-13)12-21/h2-5,13-15,18,22H,6-12H2,1H3/p+1/t13?,14?,15?,18-,21?/m1/s1