N-[4-chloranyl-1-(phenylmethyl)pyrrolidin-3-yl]-4-nitro-benzamide

Systemtic Name: N-[4-chloranyl-1-(phenylmethyl)pyrrolidin-3-yl]-4-nitro-benzamide Openeye Name: N-(1-benzyl-4-chloro-pyrrolidin-3-yl)-4-nitro-benzamide CAS Name: N-[4-chloro-1-(phenylmethyl)-3-pyrrolidinyl]-4-nitrobenzamide IUPAC Name: N-(1-benzyl-4-chloropyrrolidin-3-yl)-4-nitrobenzamide Traditional Name: N-(1-benzyl-4-chloro-pyrrolidin-3-yl)-4-nitro-benzamide Formula: C18H18ClN3O3 MolecularWeight: 359.80682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18ClN3O3/c19-16-11-21(10-13-4-2-1-3-5-13)12-17(16)20-18(23)14-6-8-15(9-7-14)22(24)25/h1-9,16-17H,10-12H2,(H,20,23)