3-morpholin-4-yl-7-(phenylmethyl)-1-piperidin-1-yl-5,6,7,8-tetrahydro-2,7-naphthyridine-2,7-diium-4-carbonitrile

Systemtic Name: 3-morpholin-4-yl-7-(phenylmethyl)-1-piperidin-1-yl-5,6,7,8-tetrahydro-2,7-naphthyridine-2,7-diium-4-carbonitrile Openeye Name: 7-benzyl-3-morpholino-1-(1-piperidyl)-5,6,7,8-tetrahydro-2,7-naphthyridine-2,7-diium-4-carbonitrile CAS Name: 3-(4-morpholinyl)-7-(phenylmethyl)-1-(1-piperidinyl)-5,6,7,8-tetrahydro-2,7-naphthyridine-2,7-diium-4-carbonitrile IUPAC Name: 7-benzyl-3-morpholin-4-yl-1-piperidin-1-yl-5,6,7,8-tetrahydro-2,7-naphthyridine-2,7-diium-4-carbonitrile Traditional Name: 7-benzyl-3-morpholino-1-piperidino-5,6,7,8-tetrahydro-2,7-naphthyridine-2,7-diium-4-carbonitrile Formula: C25H33N5O+2 MolecularWeight: 419.56242

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C3C[NH+](CCC3=C(C(=[NH+]2)N4CCOCC4)C#N)CC5=CC=CC=C5

Isomeric SMILES

C1CCN(CC1)C2=C3C[NH+](CCC3=C(C(=[NH+]2)N4CCOCC4)C#N)CC5=CC=CC=C5

InChI

InChI=1S/C25H31N5O/c26-17-22-21-9-12-28(18-20-7-3-1-4-8-20)19-23(21)25(29-10-5-2-6-11-29)27-24(22)30-13-15-31-16-14-30/h1,3-4,7-8H,2,5-6,9-16,18-19H2/p+2