2-[1-[(4-nitrophenyl)methyl]pyrrolidin-3-yl]oxybenzoic acid

Systemtic Name: 2-[1-[(4-nitrophenyl)methyl]pyrrolidin-3-yl]oxybenzoic acid Openeye Name: 2-[1-[(4-nitrophenyl)methyl]pyrrolidin-3-yl]oxybenzoic acid CAS Name: 2-[[1-[(4-nitrophenyl)methyl]-3-pyrrolidinyl]oxy]benzoic acid IUPAC Name: 2-[1-[(4-nitrophenyl)methyl]pyrrolidin-3-yl]oxybenzoic acid Traditional Name: 2-[1-(4-nitrobenzyl)pyrrolidin-3-yl]oxybenzoic acid Formula: C18H18N2O5 MolecularWeight: 342.34592

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1OC2=CC=CC=C2C(=O)O)CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CC1OC2=CC=CC=C2C(=O)O)CC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H18N2O5/c21-18(22)16-3-1-2-4-17(16)25-15-9-10-19(12-15)11-13-5-7-14(8-6-13)20(23)24/h1-8,15H,9-12H2,(H,21,22)