1-[4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]-2-(2-methylindol-1-yl)ethanone

Systemtic Name: 1-[4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]-2-(2-methylindol-1-yl)ethanone Openeye Name: 1-[4-(4-chloro-2-nitro-phenyl)piperazin-1-yl]-2-(2-methylindol-1-yl)ethanone CAS Name: 1-[4-(4-chloro-2-nitrophenyl)-1-piperazinyl]-2-(2-methyl-1-indolyl)ethanone IUPAC Name: 1-[4-(4-chloro-2-nitrophenyl)piperazin-1-yl]-2-(2-methylindol-1-yl)ethanone Traditional Name: 1-[4-(4-chloro-2-nitro-phenyl)piperazino]-2-(2-methylindol-1-yl)ethanone Formula: C21H21ClN4O3 MolecularWeight: 412.86944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC=CC=C2N1CC(=O)N3CCN(CC3)C4=C(C=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=CC2=CC=CC=C2N1CC(=O)N3CCN(CC3)C4=C(C=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H21ClN4O3/c1-15-12-16-4-2-3-5-18(16)25(15)14-21(27)24-10-8-23(9-11-24)19-7-6-17(22)13-20(19)26(28)29/h2-7,12-13H,8-11,14H2,1H3