4-(2-azanyl-2-oxidanylidene-ethoxy)-3-chloranyl-5-methoxy-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]benzamide

Systemtic Name: 4-(2-azanyl-2-oxidanylidene-ethoxy)-3-chloranyl-5-methoxy-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]benzamide Openeye Name: 4-(2-amino-2-oxo-ethoxy)-3-chloro-5-methoxy-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]benzamide CAS Name: 4-(2-amino-2-oxoethoxy)-3-chloro-5-methoxy-N-[4-(4-methyl-1-piperazin-4-iumyl)phenyl]benzamide IUPAC Name: 4-(2-amino-2-oxoethoxy)-3-chloro-5-methoxy-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]benzamide Traditional Name: 4-(2-amino-2-keto-ethoxy)-3-chloro-5-methoxy-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]benzamide Formula: C21H26ClN4O4+ MolecularWeight: 433.90854

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=CC(=C(C(=C3)Cl)OCC(=O)N)OC

Isomeric SMILES

C[NH+]1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=CC(=C(C(=C3)Cl)OCC(=O)N)OC

InChI

InChI=1S/C21H25ClN4O4/c1-25-7-9-26(10-8-25)16-5-3-15(4-6-16)24-21(28)14-11-17(22)20(18(12-14)29-2)30-13-19(23)27/h3-6,11-12H,7-10,13H2,1-2H3,(H2,23,27)(H,24,28)/p+1