(3-chloranyl-5-methoxy-4-propan-2-yloxy-phenyl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone

Systemtic Name: (3-chloranyl-5-methoxy-4-propan-2-yloxy-phenyl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone Openeye Name: (3-chloro-4-isopropoxy-5-methoxy-phenyl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone CAS Name: (3-chloro-5-methoxy-4-propan-2-yloxyphenyl)-[4-(4-nitrophenyl)-1-piperazinyl]methanone IUPAC Name: (3-chloro-5-methoxy-4-propan-2-yloxyphenyl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone Traditional Name: (3-chloro-4-isopropoxy-5-methoxy-phenyl)-[4-(4-nitrophenyl)piperazino]methanone Formula: C21H24ClN3O5 MolecularWeight: 433.88536

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1Cl)C(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-])OC

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1Cl)C(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C21H24ClN3O5/c1-14(2)30-20-18(22)12-15(13-19(20)29-3)21(26)24-10-8-23(9-11-24)16-4-6-17(7-5-16)25(27)28/h4-7,12-14H,8-11H2,1-3H3