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

Systemtic Name: 3-nitro-N-[4-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]phenyl]-4-pyrrolidin-1-yl-benzamide Openeye Name: 3-nitro-N-[4-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]phenyl]-4-pyrrolidin-1-yl-benzamide CAS Name: 3-nitro-N-[4-[4-[(E)-1-oxo-3-phenylprop-2-enyl]-1-piperazinyl]phenyl]-4-(1-pyrrolidinyl)benzamide IUPAC Name: 3-nitro-N-[4-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]phenyl]-4-pyrrolidin-1-ylbenzamide Traditional Name: 3-nitro-N-[4-[4-[(E)-3-phenylacryloyl]piperazino]phenyl]-4-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)C(=O)NC3=CC=C(C=C3)N4CCN(CC4)C(=O)C=CC5=CC=CC=C5)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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