3-[4-(2-morpholin-4-yl-2-oxidanylidene-ethyl)piperazin-4-ium-1-yl]-1-phenyl-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carbonitrile

Systemtic Name: 3-[4-(2-morpholin-4-yl-2-oxidanylidene-ethyl)piperazin-4-ium-1-yl]-1-phenyl-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carbonitrile Openeye Name: 3-[4-(2-morpholino-2-oxo-ethyl)piperazin-4-ium-1-yl]-1-phenyl-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carbonitrile CAS Name: 3-[4-[2-(4-morpholinyl)-2-oxoethyl]-1-piperazin-4-iumyl]-1-phenyl-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carbonitrile IUPAC Name: 3-[4-(2-morpholin-4-yl-2-oxoethyl)piperazin-4-ium-1-yl]-1-phenyl-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carbonitrile Traditional Name: 3-[4-(2-keto-2-morpholino-ethyl)piperazin-4-ium-1-yl]-1-phenyl-2-pyrindan-4-carbonitrile Formula: C25H30N5O2+ MolecularWeight: 432.538

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(=NC(=C2C1)C3=CC=CC=C3)N4CC[NH+](CC4)CC(=O)N5CCOCC5)C#N

Isomeric SMILES

C1CC2=C(C(=NC(=C2C1)C3=CC=CC=C3)N4CC[NH+](CC4)CC(=O)N5CCOCC5)C#N

InChI

InChI=1S/C25H29N5O2/c26-17-22-20-7-4-8-21(20)24(19-5-2-1-3-6-19)27-25(22)30-11-9-28(10-12-30)18-23(31)29-13-15-32-16-14-29/h1-3,5-6H,4,7-16,18H2/p+1