(3S,4R)-3-(4-methoxyphenyl)-4-nitro-1-(phenylmethyl)pyrrolidine

Systemtic Name: (3S,4R)-3-(4-methoxyphenyl)-4-nitro-1-(phenylmethyl)pyrrolidine Openeye Name: (3S,4R)-1-benzyl-3-(4-methoxyphenyl)-4-nitro-pyrrolidine CAS Name: (3S,4R)-3-(4-methoxyphenyl)-4-nitro-1-(phenylmethyl)pyrrolidine IUPAC Name: (3S,4R)-1-benzyl-3-(4-methoxyphenyl)-4-nitropyrrolidine Traditional Name: (3S,4R)-1-benzyl-3-(4-methoxyphenyl)-4-nitro-pyrrolidine Formula: C18H20N2O3 MolecularWeight: 312.363

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CN(CC2[N+](=O)[O-])CC3=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C18H20N2O3/c1-23-16-9-7-15(8-10-16)17-12-19(13-18(17)20(21)22)11-14-5-3-2-4-6-14/h2-10,17-18H,11-13H2,1H3/t17-,18+/m1/s1