(3-methyl-2-nitro-phenyl)-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]methanone

Systemtic Name: (3-methyl-2-nitro-phenyl)-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]methanone Openeye Name: [4-[(E)-cinnamyl]piperazin-1-yl]-(3-methyl-2-nitro-phenyl)methanone CAS Name: (3-methyl-2-nitrophenyl)-[4-[(E)-3-phenylprop-2-enyl]-1-piperazinyl]methanone IUPAC Name: (3-methyl-2-nitrophenyl)-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]methanone Traditional Name: [4-[(E)-cinnamyl]piperazino]-(3-methyl-2-nitro-phenyl)methanone Formula: C21H23N3O3 MolecularWeight: 365.42562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)N2CCN(CC2)CC=CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)N2CCN(CC2)C/C=C/C3=CC=CC=C3

InChI

InChI=1S/C21H23N3O3/c1-17-7-5-11-19(20(17)24(26)27)21(25)23-15-13-22(14-16-23)12-6-10-18-8-3-2-4-9-18/h2-11H,12-16H2,1H3/b10-6+