2-chloranyl-N-[3-oxidanylidene-3-[4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)piperazin-4-ium-1-yl]propyl]benzamide

Systemtic Name: 2-chloranyl-N-[3-oxidanylidene-3-[4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)piperazin-4-ium-1-yl]propyl]benzamide Openeye Name: 2-chloro-N-[3-oxo-3-[4-(2-oxo-2-pyrrolidin-1-yl-ethyl)piperazin-4-ium-1-yl]propyl]benzamide CAS Name: 2-chloro-N-[3-oxo-3-[4-[2-oxo-2-(1-pyrrolidinyl)ethyl]-1-piperazin-4-iumyl]propyl]benzamide IUPAC Name: 2-chloro-N-[3-oxo-3-[4-(2-oxo-2-pyrrolidin-1-ylethyl)piperazin-4-ium-1-yl]propyl]benzamide Traditional Name: 2-chloro-N-[3-keto-3-[4-(2-keto-2-pyrrolidino-ethyl)piperazin-4-ium-1-yl]propyl]benzamide Formula: C20H28ClN4O3+ MolecularWeight: 407.91432

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C[NH+]2CCN(CC2)C(=O)CCNC(=O)C3=CC=CC=C3Cl

Isomeric SMILES

C1CCN(C1)C(=O)C[NH+]2CCN(CC2)C(=O)CCNC(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C20H27ClN4O3/c21-17-6-2-1-5-16(17)20(28)22-8-7-18(26)25-13-11-23(12-14-25)15-19(27)24-9-3-4-10-24/h1-2,5-6H,3-4,7-15H2,(H,22,28)/p+1