4-hexanoyl-2-(8-methylquinolin-7-yl)-3-(pyrrolidin-1-ylmethyl)benzamide

Systemtic Name: 4-hexanoyl-2-(8-methylquinolin-7-yl)-3-(pyrrolidin-1-ylmethyl)benzamide Openeye Name: 4-hexanoyl-2-(8-methyl-7-quinolyl)-3-(pyrrolidin-1-ylmethyl)benzamide CAS Name: 2-(8-methyl-7-quinolinyl)-4-(1-oxohexyl)-3-(1-pyrrolidinylmethyl)benzamide IUPAC Name: 4-hexanoyl-2-(8-methylquinolin-7-yl)-3-(pyrrolidin-1-ylmethyl)benzamide Traditional Name: 4-caproyl-2-(8-methyl-7-quinolyl)-3-(pyrrolidinomethyl)benzamide Formula: C28H33N3O2 MolecularWeight: 443.58052

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)C1=C(C(=C(C=C1)C(=O)N)C2=C(C3=C(C=CC=N3)C=C2)C)CN4CCCC4

Isomeric SMILES

CCCCCC(=O)C1=C(C(=C(C=C1)C(=O)N)C2=C(C3=C(C=CC=N3)C=C2)C)CN4CCCC4

InChI

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