2-[3-[(3-bromanyl-2,5-diethoxy-phenyl)methylamino]propylamino]-1H-quinolin-4-one

Systemtic Name: 2-[3-[(3-bromanyl-2,5-diethoxy-phenyl)methylamino]propylamino]-1H-quinolin-4-one Openeye Name: 2-[3-[(3-bromo-2,5-diethoxy-phenyl)methylamino]propylamino]-1H-quinolin-4-one CAS Name: 2-[3-[(3-bromo-2,5-diethoxyphenyl)methylamino]propylamino]-1H-quinolin-4-one IUPAC Name: 2-[3-[(3-bromo-2,5-diethoxyphenyl)methylamino]propylamino]-1H-quinolin-4-one Traditional Name: 2-[3-[(3-bromo-2,5-diethoxy-benzyl)amino]propylamino]-4-quinolone Formula: C23H28BrN3O3 MolecularWeight: 474.39072

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C(=C1)CNCCCNC2=CC(=O)C3=CC=CC=C3N2)OCC)Br

Isomeric SMILES

CCOC1=CC(=C(C(=C1)CNCCCNC2=CC(=O)C3=CC=CC=C3N2)OCC)Br

InChI

InChI=1S/C23H28BrN3O3/c1-3-29-17-12-16(23(30-4-2)19(24)13-17)15-25-10-7-11-26-22-14-21(28)18-8-5-6-9-20(18)27-22/h5-6,8-9,12-14,25H,3-4,7,10-11,15H2,1-2H3,(H2,26,27,28)