N-[(4S,5S,7R)-2,9-dimethyl-7-(methylcarbamoyl)-5-oxidanyl-decan-4-yl]quinoline-3-carboxamide

Systemtic Name: N-[(4S,5S,7R)-2,9-dimethyl-7-(methylcarbamoyl)-5-oxidanyl-decan-4-yl]quinoline-3-carboxamide Openeye Name: N-[(1S,2S,4R)-2-hydroxy-1-isobutyl-6-methyl-4-(methylcarbamoyl)heptyl]quinoline-3-carboxamide CAS Name: N-[(4S,5S,7R)-5-hydroxy-2,9-dimethyl-7-(methylcarbamoyl)decan-4-yl]-3-quinolinecarboxamide IUPAC Name: N-[(4S,5S,7R)-5-hydroxy-2,9-dimethyl-7-(methylcarbamoyl)decan-4-yl]quinoline-3-carboxamide Traditional Name: N-[(1S,2S,4R)-2-hydroxy-1-isobutyl-6-methyl-4-(methylcarbamoyl)heptyl]quinoline-3-carboxamide Formula: C24H35N3O3 MolecularWeight: 413.553

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CC(C(CC(C)C)NC(=O)C1=CC2=CC=CC=C2N=C1)O)C(=O)NC

Isomeric SMILES

CC(C)C[C@H](C[C@@H]([C@H](CC(C)C)NC(=O)C1=CC2=CC=CC=C2N=C1)O)C(=O)NC

InChI

InChI=1S/C24H35N3O3/c1-15(2)10-18(23(29)25-5)13-22(28)21(11-16(3)4)27-24(30)19-12-17-8-6-7-9-20(17)26-14-19/h6-9,12,14-16,18,21-22,28H,10-11,13H2,1-5H3,(H,25,29)(H,27,30)/t18-,21+,22+/m1/s1