4-(3-methylbut-2-enoxy)-1-octyl-3-oxidanyl-7-[(phenylmethyl)amino]quinolin-2-one

Systemtic Name: 4-(3-methylbut-2-enoxy)-1-octyl-3-oxidanyl-7-[(phenylmethyl)amino]quinolin-2-one Openeye Name: 7-(benzylamino)-3-hydroxy-4-(3-methylbut-2-enoxy)-1-octyl-quinolin-2-one CAS Name: 3-hydroxy-4-(3-methylbut-2-enoxy)-1-octyl-7-[(phenylmethyl)amino]-2-quinolinone IUPAC Name: 7-(benzylamino)-3-hydroxy-4-(3-methylbut-2-enoxy)-1-octylquinolin-2-one Traditional Name: 7-(benzylamino)-3-hydroxy-4-(3-methylbut-2-enoxy)-1-octyl-carbostyril Formula: C29H38N2O3 MolecularWeight: 462.62362

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1C2=C(C=CC(=C2)NCC3=CC=CC=C3)C(=C(C1=O)O)OCC=C(C)C

Isomeric SMILES

CCCCCCCCN1C2=C(C=CC(=C2)NCC3=CC=CC=C3)C(=C(C1=O)O)OCC=C(C)C

InChI

InChI=1S/C29H38N2O3/c1-4-5-6-7-8-12-18-31-26-20-24(30-21-23-13-10-9-11-14-23)15-16-25(26)28(27(32)29(31)33)34-19-17-22(2)3/h9-11,13-17,20,30,32H,4-8,12,18-19,21H2,1-3H3