N-(2-chloranyl-4-nitro-phenyl)-2-[4-[2-(2-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]piperazin-1-yl]propanamide

Systemtic Name: N-(2-chloranyl-4-nitro-phenyl)-2-[4-[2-(2-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]piperazin-1-yl]propanamide Openeye Name: N-(2-chloro-4-nitro-phenyl)-2-[4-[2-(2-methyl-1-piperidyl)-2-oxo-ethyl]piperazin-1-yl]propanamide CAS Name: N-(2-chloro-4-nitrophenyl)-2-[4-[2-(2-methyl-1-piperidinyl)-2-oxoethyl]-1-piperazinyl]propanamide IUPAC Name: N-(2-chloro-4-nitrophenyl)-2-[4-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]propanamide Traditional Name: N-(2-chloro-4-nitro-phenyl)-2-[4-[2-keto-2-(2-methylpiperidino)ethyl]piperazino]propionamide Formula: C21H30ClN5O4 MolecularWeight: 451.947

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C(=O)CN2CCN(CC2)C(C)C(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CC1CCCCN1C(=O)CN2CCN(CC2)C(C)C(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C21H30ClN5O4/c1-15-5-3-4-8-26(15)20(28)14-24-9-11-25(12-10-24)16(2)21(29)23-19-7-6-17(27(30)31)13-18(19)22/h6-7,13,15-16H,3-5,8-12,14H2,1-2H3,(H,23,29)