3-[4-[(4-chlorophenyl)-phenyl-methyl]piperazin-1-yl]-1-(4-nitrophenyl)propan-1-one

Systemtic Name: 3-[4-[(4-chlorophenyl)-phenyl-methyl]piperazin-1-yl]-1-(4-nitrophenyl)propan-1-one Openeye Name: 3-[4-[(4-chlorophenyl)-phenyl-methyl]piperazin-1-yl]-1-(4-nitrophenyl)propan-1-one CAS Name: 3-[4-[(4-chlorophenyl)-phenylmethyl]-1-piperazinyl]-1-(4-nitrophenyl)-1-propanone IUPAC Name: 3-[4-[(4-chlorophenyl)-phenylmethyl]piperazin-1-yl]-1-(4-nitrophenyl)propan-1-one Traditional Name: 3-[4-[(4-chlorophenyl)-phenyl-methyl]piperazino]-1-(4-nitrophenyl)propan-1-one Formula: C26H26ClN3O3 MolecularWeight: 463.95594

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C(C3=CC=CC=C3)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CN(CCN1CCC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C(C3=CC=CC=C3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C26H26ClN3O3/c27-23-10-6-22(7-11-23)26(21-4-2-1-3-5-21)29-18-16-28(17-19-29)15-14-25(31)20-8-12-24(13-9-20)30(32)33/h1-13,26H,14-19H2