(2R)-2-cyclopentyl-2-[3-(nitrooxymethyl)-4-(quinolin-2-ylmethoxy)phenyl]ethanoic acid

Systemtic Name: (2R)-2-cyclopentyl-2-[3-(nitrooxymethyl)-4-(quinolin-2-ylmethoxy)phenyl]ethanoic acid Openeye Name: (2R)-2-cyclopentyl-2-[3-(nitrooxymethyl)-4-(2-quinolylmethoxy)phenyl]acetic acid CAS Name: (2R)-2-cyclopentyl-2-[3-(nitrooxymethyl)-4-(2-quinolinylmethoxy)phenyl]acetic acid IUPAC Name: (2R)-2-cyclopentyl-2-[3-(nitrooxymethyl)-4-(quinolin-2-ylmethoxy)phenyl]acetic acid Traditional Name: (2R)-2-cyclopentyl-2-[3-(nitrooxymethyl)-4-(2-quinolylmethoxy)phenyl]acetic acid Formula: C24H24N2O6 MolecularWeight: 436.45716

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C(C2=CC(=C(C=C2)OCC3=NC4=CC=CC=C4C=C3)CO[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1CCC(C1)[C@H](C2=CC(=C(C=C2)OCC3=NC4=CC=CC=C4C=C3)CO[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C24H24N2O6/c27-24(28)23(17-6-1-2-7-17)18-10-12-22(19(13-18)14-32-26(29)30)31-15-20-11-9-16-5-3-4-8-21(16)25-20/h3-5,8-13,17,23H,1-2,6-7,14-15H2,(H,27,28)/t23-/m1/s1