(2-nitrophenyl)-[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-yl]methanone

Systemtic Name: (2-nitrophenyl)-[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-yl]methanone Openeye Name: [4-[(4-isopropylphenyl)methyl]piperazin-1-yl]-(2-nitrophenyl)methanone CAS Name: (2-nitrophenyl)-[4-[(4-propan-2-ylphenyl)methyl]-1-piperazinyl]methanone IUPAC Name: (2-nitrophenyl)-[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-yl]methanone Traditional Name: [4-(4-isopropylbenzyl)piperazino]-(2-nitrophenyl)methanone Formula: C21H25N3O3 MolecularWeight: 367.4415

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CN2CCN(CC2)C(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CN2CCN(CC2)C(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C21H25N3O3/c1-16(2)18-9-7-17(8-10-18)15-22-11-13-23(14-12-22)21(25)19-5-3-4-6-20(19)24(26)27/h3-10,16H,11-15H2,1-2H3