5-nitro-N-[4-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]phenyl]-2-pyrrolidin-1-yl-benzamide

Systemtic Name: 5-nitro-N-[4-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]phenyl]-2-pyrrolidin-1-yl-benzamide Openeye Name: 5-nitro-N-[4-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]phenyl]-2-pyrrolidin-1-yl-benzamide CAS Name: 5-nitro-N-[4-[4-[(E)-1-oxo-3-phenylprop-2-enyl]-1-piperazinyl]phenyl]-2-(1-pyrrolidinyl)benzamide IUPAC Name: 5-nitro-N-[4-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]phenyl]-2-pyrrolidin-1-ylbenzamide Traditional Name: 5-nitro-N-[4-[4-[(E)-3-phenylacryloyl]piperazino]phenyl]-2-pyrrolidino-benzamide Formula: C30H31N5O4 MolecularWeight: 525.59824

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC3=CC=C(C=C3)N4CCN(CC4)C(=O)C=CC5=CC=CC=C5

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC3=CC=C(C=C3)N4CCN(CC4)C(=O)/C=C/C5=CC=CC=C5

InChI

InChI=1S/C30H31N5O4/c36-29(15-8-23-6-2-1-3-7-23)34-20-18-32(19-21-34)25-11-9-24(10-12-25)31-30(37)27-22-26(35(38)39)13-14-28(27)33-16-4-5-17-33/h1-3,6-15,22H,4-5,16-21H2,(H,31,37)/b15-8+