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

Systemtic Name: 4-methoxy-1-octyl-7-[(phenylmethyl)amino]-3-prop-2-enoxy-quinolin-2-one Openeye Name: 3-allyloxy-7-(benzylamino)-4-methoxy-1-octyl-quinolin-2-one CAS Name: 4-methoxy-1-octyl-7-[(phenylmethyl)amino]-3-prop-2-enoxy-2-quinolinone IUPAC Name: 7-(benzylamino)-4-methoxy-1-octyl-3-prop-2-enoxyquinolin-2-one Traditional Name: 3-allyloxy-7-(benzylamino)-4-methoxy-1-octyl-carbostyril Formula: C28H36N2O3 MolecularWeight: 448.59704

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H36N2O3/c1-4-6-7-8-9-13-18-30-25-20-23(29-21-22-14-11-10-12-15-22)16-17-24(25)26(32-3)27(28(30)31)33-19-5-2/h5,10-12,14-17,20,29H,2,4,6-9,13,18-19,21H2,1,3H3