N-[8-methyl-3-(pyrrolidin-1-ylmethyl)quinolin-7-yl]-4-(2-oxidanylidenehexyl)benzamide

Systemtic Name: N-[8-methyl-3-(pyrrolidin-1-ylmethyl)quinolin-7-yl]-4-(2-oxidanylidenehexyl)benzamide Openeye Name: N-[8-methyl-3-(pyrrolidin-1-ylmethyl)-7-quinolyl]-4-(2-oxohexyl)benzamide CAS Name: N-[8-methyl-3-(1-pyrrolidinylmethyl)-7-quinolinyl]-4-(2-oxohexyl)benzamide IUPAC Name: N-[8-methyl-3-(pyrrolidin-1-ylmethyl)quinolin-7-yl]-4-(2-oxohexyl)benzamide Traditional Name: 4-(2-ketohexyl)-N-[8-methyl-3-(pyrrolidinomethyl)-7-quinolyl]benzamide Formula: C28H33N3O2 MolecularWeight: 443.58052

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)CC1=CC=C(C=C1)C(=O)NC2=C(C3=NC=C(C=C3C=C2)CN4CCCC4)C

Isomeric SMILES

CCCCC(=O)CC1=CC=C(C=C1)C(=O)NC2=C(C3=NC=C(C=C3C=C2)CN4CCCC4)C

InChI

InChI=1S/C28H33N3O2/c1-3-4-7-25(32)17-21-8-10-23(11-9-21)28(33)30-26-13-12-24-16-22(18-29-27(24)20(26)2)19-31-14-5-6-15-31/h8-13,16,18H,3-7,14-15,17,19H2,1-2H3,(H,30,33)