1-heptan-2-yl-7-[[4-[3-(hydroxymethyl)piperidin-1-yl]phenyl]amino]-3,4-dihydro-1,6-naphthyridin-2-one

Systemtic Name: 1-heptan-2-yl-7-[[4-[3-(hydroxymethyl)piperidin-1-yl]phenyl]amino]-3,4-dihydro-1,6-naphthyridin-2-one Openeye Name: 7-[4-[3-(hydroxymethyl)-1-piperidyl]anilino]-1-(1-methylhexyl)-3,4-dihydro-1,6-naphthyridin-2-one CAS Name: 1-heptan-2-yl-7-[4-[3-(hydroxymethyl)-1-piperidinyl]anilino]-3,4-dihydro-1,6-naphthyridin-2-one IUPAC Name: 1-heptan-2-yl-7-[4-[3-(hydroxymethyl)piperidin-1-yl]anilino]-3,4-dihydro-1,6-naphthyridin-2-one Traditional Name: 1-(1-methylhexyl)-7-[4-(3-methylolpiperidino)anilino]-3,4-dihydro-1,6-naphthyridin-2-one Formula: C27H38N4O2 MolecularWeight: 450.61622

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)N1C(=O)CCC2=CN=C(C=C21)NC3=CC=C(C=C3)N4CCCC(C4)CO

Isomeric SMILES

CCCCCC(C)N1C(=O)CCC2=CN=C(C=C21)NC3=CC=C(C=C3)N4CCCC(C4)CO

InChI

InChI=1S/C27H38N4O2/c1-3-4-5-7-20(2)31-25-16-26(28-17-22(25)9-14-27(31)33)29-23-10-12-24(13-11-23)30-15-6-8-21(18-30)19-32/h10-13,16-17,20-21,32H,3-9,14-15,18-19H2,1-2H3,(H,28,29)