[4-[(4-tert-butylphenyl)methyl]piperazin-1-yl]-(3-nitrophenyl)methanone

Systemtic Name: [4-[(4-tert-butylphenyl)methyl]piperazin-1-yl]-(3-nitrophenyl)methanone Openeye Name: [4-[(4-tert-butylphenyl)methyl]piperazin-1-yl]-(3-nitrophenyl)methanone CAS Name: [4-[(4-tert-butylphenyl)methyl]-1-piperazinyl]-(3-nitrophenyl)methanone IUPAC Name: [4-[(4-tert-butylphenyl)methyl]piperazin-1-yl]-(3-nitrophenyl)methanone Traditional Name: [4-(4-tert-butylbenzyl)piperazino]-(3-nitrophenyl)methanone Formula: C22H27N3O3 MolecularWeight: 381.46808

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O3/c1-22(2,3)19-9-7-17(8-10-19)16-23-11-13-24(14-12-23)21(26)18-5-4-6-20(15-18)25(27)28/h4-10,15H,11-14,16H2,1-3H3