2-heptadecan-9-yl-3-methyl-1H-quinolin-4-one

Systemtic Name: 2-heptadecan-9-yl-3-methyl-1H-quinolin-4-one Openeye Name: 3-methyl-2-(1-octylnonyl)-1H-quinolin-4-one CAS Name: 2-heptadecan-9-yl-3-methyl-1H-quinolin-4-one IUPAC Name: 2-heptadecan-9-yl-3-methyl-1H-quinolin-4-one Traditional Name: 3-methyl-2-(1-octylnonyl)-4-quinolone Formula: C27H43NO MolecularWeight: 397.63642

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(CCCCCCCC)C1=C(C(=O)C2=CC=CC=C2N1)C

Isomeric SMILES

CCCCCCCCC(CCCCCCCC)C1=C(C(=O)C2=CC=CC=C2N1)C

InChI

InChI=1S/C27H43NO/c1-4-6-8-10-12-14-18-23(19-15-13-11-9-7-5-2)26-22(3)27(29)24-20-16-17-21-25(24)28-26/h16-17,20-21,23H,4-15,18-19H2,1-3H3,(H,28,29)