5-chloranyl-N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]-2-nitro-aniline

Systemtic Name: 5-chloranyl-N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]-2-nitro-aniline Openeye Name: 5-chloro-N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]-2-nitro-aniline CAS Name: 5-chloro-N-[4-[4-(2-methoxyphenyl)-1-piperazinyl]butyl]-2-nitroaniline IUPAC Name: 5-chloro-N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]-2-nitroaniline Traditional Name: (5-chloro-2-nitro-phenyl)-[4-[4-(2-methoxyphenyl)piperazino]butyl]amine Formula: C21H27ClN4O3 MolecularWeight: 418.91708

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)CCCCNC3=C(C=CC(=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)CCCCNC3=C(C=CC(=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H27ClN4O3/c1-29-21-7-3-2-6-20(21)25-14-12-24(13-15-25)11-5-4-10-23-18-16-17(22)8-9-19(18)26(27)28/h2-3,6-9,16,23H,4-5,10-15H2,1H3