1-(4-chlorophenyl)-3-[4-(2-morpholin-4-ium-4-ylethyl)piperidin-1-yl]pyrrole-2,5-dione

Systemtic Name: 1-(4-chlorophenyl)-3-[4-(2-morpholin-4-ium-4-ylethyl)piperidin-1-yl]pyrrole-2,5-dione Openeye Name: 1-(4-chlorophenyl)-3-[4-(2-morpholin-4-ium-4-ylethyl)-1-piperidyl]pyrrole-2,5-dione CAS Name: 1-(4-chlorophenyl)-3-[4-[2-(4-morpholin-4-iumyl)ethyl]-1-piperidinyl]pyrrole-2,5-dione IUPAC Name: 1-(4-chlorophenyl)-3-[4-(2-morpholin-4-ium-4-ylethyl)piperidin-1-yl]pyrrole-2,5-dione Traditional Name: 1-(4-chlorophenyl)-3-[4-(2-morpholin-4-ium-4-ylethyl)piperidino]-3-pyrroline-2,5-quinone Formula: C21H27ClN3O3+ MolecularWeight: 404.91038

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC[NH+]2CCOCC2)C3=CC(=O)N(C3=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CN(CCC1CC[NH+]2CCOCC2)C3=CC(=O)N(C3=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H26ClN3O3/c22-17-1-3-18(4-2-17)25-20(26)15-19(21(25)27)24-9-6-16(7-10-24)5-8-23-11-13-28-14-12-23/h1-4,15-16H,5-14H2/p+1