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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H33N3O2/c1-3-4-5-8-26(32)22-9-11-23(12-10-22)28(33)30-25-14-13-24-17-21(18-29-27(24)20(25)2)19-31-15-6-7-16-31/h9-14,17-18H,3-8,15-16,19H2,1-2H3,(H,30,33)