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

Systemtic Name: 1-[4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]-2-(cyclooctylamino)ethanone Openeye Name: 1-[4-(4-chloro-2-nitro-phenyl)piperazin-1-yl]-2-(cyclooctylamino)ethanone CAS Name: 1-[4-(4-chloro-2-nitrophenyl)-1-piperazinyl]-2-(cyclooctylamino)ethanone IUPAC Name: 1-[4-(4-chloro-2-nitrophenyl)piperazin-1-yl]-2-(cyclooctylamino)ethanone Traditional Name: 1-[4-(4-chloro-2-nitro-phenyl)piperazino]-2-(cyclooctylamino)ethanone Formula: C20H29ClN4O3 MolecularWeight: 408.92226

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)NCC(=O)N2CCN(CC2)C3=C(C=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CCCC(CCC1)NCC(=O)N2CCN(CC2)C3=C(C=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H29ClN4O3/c21-16-8-9-18(19(14-16)25(27)28)23-10-12-24(13-11-23)20(26)15-22-17-6-4-2-1-3-5-7-17/h8-9,14,17,22H,1-7,10-13,15H2