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

Systemtic Name: 1-morpholin-4-yl-7-(phenylmethyl)-3-pyrrolidin-1-yl-5,6,7,8-tetrahydro-2,7-naphthyridine-2,7-diium-4-carbonitrile Openeye Name: 7-benzyl-1-morpholino-3-pyrrolidin-1-yl-5,6,7,8-tetrahydro-2,7-naphthyridine-2,7-diium-4-carbonitrile CAS Name: 1-(4-morpholinyl)-7-(phenylmethyl)-3-(1-pyrrolidinyl)-5,6,7,8-tetrahydro-2,7-naphthyridine-2,7-diium-4-carbonitrile IUPAC Name: 7-benzyl-1-morpholin-4-yl-3-pyrrolidin-1-yl-5,6,7,8-tetrahydro-2,7-naphthyridine-2,7-diium-4-carbonitrile Traditional Name: 7-benzyl-1-morpholino-3-pyrrolidino-5,6,7,8-tetrahydro-2,7-naphthyridine-2,7-diium-4-carbonitrile Formula: C24H31N5O+2 MolecularWeight: 405.53584

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=[NH+]C(=C3C[NH+](CCC3=C2C#N)CC4=CC=CC=C4)N5CCOCC5

Isomeric SMILES

C1CCN(C1)C2=[NH+]C(=C3C[NH+](CCC3=C2C#N)CC4=CC=CC=C4)N5CCOCC5

InChI

InChI=1S/C24H29N5O/c25-16-21-20-8-11-27(17-19-6-2-1-3-7-19)18-22(20)24(29-12-14-30-15-13-29)26-23(21)28-9-4-5-10-28/h1-3,6-7H,4-5,8-15,17-18H2/p+2