3-nitro-N-[1-[4-(propanoylamino)phenyl]ethyl]-4-pyrrolidin-1-yl-benzamide

Systemtic Name: 3-nitro-N-[1-[4-(propanoylamino)phenyl]ethyl]-4-pyrrolidin-1-yl-benzamide Openeye Name: 3-nitro-N-[1-[4-(propanoylamino)phenyl]ethyl]-4-pyrrolidin-1-yl-benzamide CAS Name: 3-nitro-N-[1-[4-(1-oxopropylamino)phenyl]ethyl]-4-(1-pyrrolidinyl)benzamide IUPAC Name: 3-nitro-N-[1-[4-(propanoylamino)phenyl]ethyl]-4-pyrrolidin-1-ylbenzamide Traditional Name: 3-nitro-N-[1-(4-propionamidophenyl)ethyl]-4-pyrrolidino-benzamide Formula: C22H26N4O4 MolecularWeight: 410.46624

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)C(C)NC(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)C(C)NC(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C22H26N4O4/c1-3-21(27)24-18-9-6-16(7-10-18)15(2)23-22(28)17-8-11-19(20(14-17)26(29)30)25-12-4-5-13-25/h6-11,14-15H,3-5,12-13H2,1-2H3,(H,23,28)(H,24,27)