(2R)-2-(4-methoxyphenyl)-1-[(4-nitrophenyl)methyl]pyrrolidin-1-ium

Systemtic Name: (2R)-2-(4-methoxyphenyl)-1-[(4-nitrophenyl)methyl]pyrrolidin-1-ium Openeye Name: (2R)-2-(4-methoxyphenyl)-1-[(4-nitrophenyl)methyl]pyrrolidin-1-ium CAS Name: (2R)-2-(4-methoxyphenyl)-1-[(4-nitrophenyl)methyl]pyrrolidin-1-ium IUPAC Name: (2R)-2-(4-methoxyphenyl)-1-[(4-nitrophenyl)methyl]pyrrolidin-1-ium Traditional Name: (2R)-2-(4-methoxyphenyl)-1-(4-nitrobenzyl)pyrrolidin-1-ium Formula: C18H21N2O3+ MolecularWeight: 313.37094

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CCC[NH+]2CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)[C@H]2CCC[NH+]2CC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H20N2O3/c1-23-17-10-6-15(7-11-17)18-3-2-12-19(18)13-14-4-8-16(9-5-14)20(21)22/h4-11,18H,2-3,12-13H2,1H3/p+1/t18-/m1/s1