[(3R,4S)-1-methyl-4-(4-methylphenyl)-3-nitro-pyrrolidin-3-yl]methanol

Systemtic Name: [(3R,4S)-1-methyl-4-(4-methylphenyl)-3-nitro-pyrrolidin-3-yl]methanol Openeye Name: [(3R,4S)-1-methyl-3-nitro-4-(p-tolyl)pyrrolidin-3-yl]methanol CAS Name: [(3R,4S)-1-methyl-4-(4-methylphenyl)-3-nitro-3-pyrrolidinyl]methanol IUPAC Name: [(3R,4S)-1-methyl-4-(4-methylphenyl)-3-nitropyrrolidin-3-yl]methanol Traditional Name: [(3R,4S)-1-methyl-3-nitro-4-(p-tolyl)pyrrolidin-3-yl]methanol Formula: C13H18N2O3 MolecularWeight: 250.29362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2CN(CC2(CO)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC=C(C=C1)[C@H]2CN(C[C@]2(CO)[N+](=O)[O-])C

InChI

InChI=1S/C13H18N2O3/c1-10-3-5-11(6-4-10)12-7-14(2)8-13(12,9-16)15(17)18/h3-6,12,16H,7-9H2,1-2H3/t12-,13-/m1/s1