(E)-1-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-3-(3-nitrophenyl)prop-2-en-1-one

Systemtic Name: (E)-1-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-3-(3-nitrophenyl)prop-2-en-1-one Openeye Name: (E)-1-[4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]-3-(3-nitrophenyl)prop-2-en-1-one CAS Name: (E)-1-[4-(5-chloro-2-methylphenyl)-1-piperazinyl]-3-(3-nitrophenyl)-2-propen-1-one IUPAC Name: (E)-1-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-3-(3-nitrophenyl)prop-2-en-1-one Traditional Name: (E)-1-[4-(5-chloro-2-methyl-phenyl)piperazino]-3-(3-nitrophenyl)prop-2-en-1-one Formula: C20H20ClN3O3 MolecularWeight: 385.8441

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)C=CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)/C=C/C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H20ClN3O3/c1-15-5-7-17(21)14-19(15)22-9-11-23(12-10-22)20(25)8-6-16-3-2-4-18(13-16)24(26)27/h2-8,13-14H,9-12H2,1H3/b8-6+