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

Systemtic Name: 1-adamantylmethyl-[(3R)-2,5-bis(oxidanylidene)-1-(4-propoxyphenyl)pyrrolidin-3-yl]azanium Openeye Name: 1-adamantylmethyl-[(3R)-2,5-dioxo-1-(4-propoxyphenyl)pyrrolidin-3-yl]ammonium CAS Name: 1-adamantylmethyl-[(3R)-2,5-dioxo-1-(4-propoxyphenyl)-3-pyrrolidinyl]ammonium IUPAC Name: 1-adamantylmethyl-[(3R)-2,5-dioxo-1-(4-propoxyphenyl)pyrrolidin-3-yl]azanium Traditional Name: 1-adamantylmethyl-[(3R)-2,5-diketo-1-(4-propoxyphenyl)pyrrolidin-3-yl]ammonium Formula: C24H33N2O3+ MolecularWeight: 397.53042

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)N2C(=O)CC(C2=O)[NH2+]CC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCCOC1=CC=C(C=C1)N2C(=O)C[C@H](C2=O)[NH2+]CC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C24H32N2O3/c1-2-7-29-20-5-3-19(4-6-20)26-22(27)11-21(23(26)28)25-15-24-12-16-8-17(13-24)10-18(9-16)14-24/h3-6,16-18,21,25H,2,7-15H2,1H3/p+1/t16?,17?,18?,21-,24?/m1/s1