3-[bis(2-oxidanylpropyl)amino]-1-morpholin-4-yl-7-(phenylmethyl)-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile

Systemtic Name: 3-[bis(2-oxidanylpropyl)amino]-1-morpholin-4-yl-7-(phenylmethyl)-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile Openeye Name: 7-benzyl-3-[bis(2-hydroxypropyl)amino]-1-morpholino-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile CAS Name: 3-[bis(2-hydroxypropyl)amino]-1-(4-morpholinyl)-7-(phenylmethyl)-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile IUPAC Name: 7-benzyl-3-[bis(2-hydroxypropyl)amino]-1-morpholin-4-yl-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile Traditional Name: 7-benzyl-3-[bis(2-hydroxypropyl)amino]-1-morpholino-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile Formula: C26H35N5O3 MolecularWeight: 465.5878

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN(CC(C)O)C1=NC(=C2CN(CCC2=C1C#N)CC3=CC=CC=C3)N4CCOCC4)O

Isomeric SMILES

CC(CN(CC(C)O)C1=NC(=C2CN(CCC2=C1C#N)CC3=CC=CC=C3)N4CCOCC4)O

InChI

InChI=1S/C26H35N5O3/c1-19(32)15-31(16-20(2)33)25-23(14-27)22-8-9-29(17-21-6-4-3-5-7-21)18-24(22)26(28-25)30-10-12-34-13-11-30/h3-7,19-20,32-33H,8-13,15-18H2,1-2H3