(2-methoxy-5-nitro-phenyl)-[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-yl]methanone

Systemtic Name: (2-methoxy-5-nitro-phenyl)-[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-yl]methanone Openeye Name: [4-[(4-isopropylphenyl)methyl]piperazin-1-yl]-(2-methoxy-5-nitro-phenyl)methanone CAS Name: (2-methoxy-5-nitrophenyl)-[4-[(4-propan-2-ylphenyl)methyl]-1-piperazinyl]methanone IUPAC Name: (2-methoxy-5-nitrophenyl)-[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-yl]methanone Traditional Name: [4-(4-isopropylbenzyl)piperazino]-(2-methoxy-5-nitro-phenyl)methanone Formula: C22H27N3O4 MolecularWeight: 397.46748

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O4/c1-16(2)18-6-4-17(5-7-18)15-23-10-12-24(13-11-23)22(26)20-14-19(25(27)28)8-9-21(20)29-3/h4-9,14,16H,10-13,15H2,1-3H3