4-(4-nitrophenyl)-1-(phenylmethyl)pyrrolidine-3-carboxylic acid

Systemtic Name: 4-(4-nitrophenyl)-1-(phenylmethyl)pyrrolidine-3-carboxylic acid Openeye Name: 1-benzyl-4-(4-nitrophenyl)pyrrolidine-3-carboxylic acid CAS Name: 4-(4-nitrophenyl)-1-(phenylmethyl)-3-pyrrolidinecarboxylic acid IUPAC Name: 1-benzyl-4-(4-nitrophenyl)pyrrolidine-3-carboxylic acid Traditional Name: 1-benzyl-4-(4-nitrophenyl)pyrrolidine-3-carboxylic acid Formula: C18H18N2O4 MolecularWeight: 326.34652

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(CN1CC2=CC=CC=C2)C(=O)O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1C(C(CN1CC2=CC=CC=C2)C(=O)O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H18N2O4/c21-18(22)17-12-19(10-13-4-2-1-3-5-13)11-16(17)14-6-8-15(9-7-14)20(23)24/h1-9,16-17H,10-12H2,(H,21,22)