5-nitro-N-[2-(4-propan-2-yloxyphenyl)ethyl]-2-pyrrolidin-1-yl-benzamide

Systemtic Name: 5-nitro-N-[2-(4-propan-2-yloxyphenyl)ethyl]-2-pyrrolidin-1-yl-benzamide Openeye Name: N-[2-(4-isopropoxyphenyl)ethyl]-5-nitro-2-pyrrolidin-1-yl-benzamide CAS Name: 5-nitro-N-[2-(4-propan-2-yloxyphenyl)ethyl]-2-(1-pyrrolidinyl)benzamide IUPAC Name: 5-nitro-N-[2-(4-propan-2-yloxyphenyl)ethyl]-2-pyrrolidin-1-ylbenzamide Traditional Name: N-[2-(4-isopropoxyphenyl)ethyl]-5-nitro-2-pyrrolidino-benzamide Formula: C22H27N3O4 MolecularWeight: 397.46748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)CCNC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCCC3

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)CCNC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCCC3

InChI

InChI=1S/C22H27N3O4/c1-16(2)29-19-8-5-17(6-9-19)11-12-23-22(26)20-15-18(25(27)28)7-10-21(20)24-13-3-4-14-24/h5-10,15-16H,3-4,11-14H2,1-2H3,(H,23,26)