[4-(3-methylbut-2-enyl)piperazin-1-yl]-(3-nitrophenyl)methanone

Systemtic Name: [4-(3-methylbut-2-enyl)piperazin-1-yl]-(3-nitrophenyl)methanone Openeye Name: [4-(3-methylbut-2-enyl)piperazin-1-yl]-(3-nitrophenyl)methanone CAS Name: [4-(3-methylbut-2-enyl)-1-piperazinyl]-(3-nitrophenyl)methanone IUPAC Name: [4-(3-methylbut-2-enyl)piperazin-1-yl]-(3-nitrophenyl)methanone Traditional Name: [4-(3-methylbut-2-enyl)piperazino]-(3-nitrophenyl)methanone Formula: C16H21N3O3 MolecularWeight: 303.35624

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=CCN1CCN(CC1)C(=O)C2=CC(=CC=C2)[N+](=O)[O-])C

Isomeric SMILES

CC(=CCN1CCN(CC1)C(=O)C2=CC(=CC=C2)[N+](=O)[O-])C

InChI

InChI=1S/C16H21N3O3/c1-13(2)6-7-17-8-10-18(11-9-17)16(20)14-4-3-5-15(12-14)19(21)22/h3-6,12H,7-11H2,1-2H3