morpholin-4-yl-[2-[4-(2-phenoxyethyl)piperazin-4-ium-1-yl]quinolin-4-yl]methanone

Systemtic Name: morpholin-4-yl-[2-[4-(2-phenoxyethyl)piperazin-4-ium-1-yl]quinolin-4-yl]methanone Openeye Name: morpholino-[2-[4-(2-phenoxyethyl)piperazin-4-ium-1-yl]-4-quinolyl]methanone CAS Name: 4-morpholinyl-[2-[4-(2-phenoxyethyl)-1-piperazin-4-iumyl]-4-quinolinyl]methanone IUPAC Name: morpholin-4-yl-[2-[4-(2-phenoxyethyl)piperazin-4-ium-1-yl]quinolin-4-yl]methanone Traditional Name: morpholino-[2-[4-(2-phenoxyethyl)piperazin-4-ium-1-yl]-4-quinolyl]methanone Formula: C26H31N4O3+ MolecularWeight: 447.54934

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCOC2=CC=CC=C2)C3=NC4=CC=CC=C4C(=C3)C(=O)N5CCOCC5

Isomeric SMILES

C1CN(CC[NH+]1CCOC2=CC=CC=C2)C3=NC4=CC=CC=C4C(=C3)C(=O)N5CCOCC5

InChI

InChI=1S/C26H30N4O3/c31-26(30-15-17-32-18-16-30)23-20-25(27-24-9-5-4-8-22(23)24)29-12-10-28(11-13-29)14-19-33-21-6-2-1-3-7-21/h1-9,20H,10-19H2/p+1