N-[(2S,4S)-2-methyl-1-octanoyl-3,4-dihydro-2H-quinolin-4-yl]-N-phenyl-ethanamide

Systemtic Name: N-[(2S,4S)-2-methyl-1-octanoyl-3,4-dihydro-2H-quinolin-4-yl]-N-phenyl-ethanamide Openeye Name: N-[(2S,4S)-2-methyl-1-octanoyl-3,4-dihydro-2H-quinolin-4-yl]-N-phenyl-acetamide CAS Name: N-[(2S,4S)-2-methyl-1-(1-oxooctyl)-3,4-dihydro-2H-quinolin-4-yl]-N-phenylacetamide IUPAC Name: N-[(2S,4S)-2-methyl-1-octanoyl-3,4-dihydro-2H-quinolin-4-yl]-N-phenylacetamide Traditional Name: N-[(2S,4S)-1-caprylyl-2-methyl-3,4-dihydro-2H-quinolin-4-yl]-N-phenyl-acetamide Formula: C26H34N2O2 MolecularWeight: 406.56036

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)N1C(CC(C2=CC=CC=C21)N(C3=CC=CC=C3)C(=O)C)C

Isomeric SMILES

CCCCCCCC(=O)N1[C@H](C[C@@H](C2=CC=CC=C21)N(C3=CC=CC=C3)C(=O)C)C

InChI

InChI=1S/C26H34N2O2/c1-4-5-6-7-11-18-26(30)27-20(2)19-25(23-16-12-13-17-24(23)27)28(21(3)29)22-14-9-8-10-15-22/h8-10,12-17,20,25H,4-7,11,18-19H2,1-3H3/t20-,25-/m0/s1