2-[4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]-N-[(2,4-dimethylphenyl)carbamoyl]propanamide

Systemtic Name: 2-[4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]-N-[(2,4-dimethylphenyl)carbamoyl]propanamide Openeye Name: 2-[4-(4-chloro-2-nitro-phenyl)piperazin-1-yl]-N-[(2,4-dimethylphenyl)carbamoyl]propanamide CAS Name: 2-[4-(4-chloro-2-nitrophenyl)-1-piperazinyl]-N-[(2,4-dimethylanilino)-oxomethyl]propanamide IUPAC Name: 2-[4-(4-chloro-2-nitrophenyl)piperazin-1-yl]-N-[(2,4-dimethylphenyl)carbamoyl]propanamide Traditional Name: 2-[4-(4-chloro-2-nitro-phenyl)piperazino]-N-[(2,4-dimethylphenyl)carbamoyl]propionamide Formula: C22H26ClN5O4 MolecularWeight: 459.92594

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26ClN5O4/c1-14-4-6-18(15(2)12-14)24-22(30)25-21(29)16(3)26-8-10-27(11-9-26)19-7-5-17(23)13-20(19)28(31)32/h4-7,12-13,16H,8-11H2,1-3H3,(H2,24,25,29,30)