2-[[3-[(3,4-dichlorophenyl)methylamino]-2-phenylmethoxy-propyl]amino]-1H-quinolin-4-one

Systemtic Name: 2-[[3-[(3,4-dichlorophenyl)methylamino]-2-phenylmethoxy-propyl]amino]-1H-quinolin-4-one Openeye Name: 2-[[2-benzyloxy-3-[(3,4-dichlorophenyl)methylamino]propyl]amino]-1H-quinolin-4-one CAS Name: 2-[[3-[(3,4-dichlorophenyl)methylamino]-2-phenylmethoxypropyl]amino]-1H-quinolin-4-one IUPAC Name: 2-[[3-[(3,4-dichlorophenyl)methylamino]-2-phenylmethoxypropyl]amino]-1H-quinolin-4-one Traditional Name: 2-[[2-benzoxy-3-[(3,4-dichlorobenzyl)amino]propyl]amino]-4-quinolone Formula: C26H25Cl2N3O2 MolecularWeight: 482.4016

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(CNCC2=CC(=C(C=C2)Cl)Cl)CNC3=CC(=O)C4=CC=CC=C4N3

Isomeric SMILES

C1=CC=C(C=C1)COC(CNCC2=CC(=C(C=C2)Cl)Cl)CNC3=CC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C26H25Cl2N3O2/c27-22-11-10-19(12-23(22)28)14-29-15-20(33-17-18-6-2-1-3-7-18)16-30-26-13-25(32)21-8-4-5-9-24(21)31-26/h1-13,20,29H,14-17H2,(H2,30,31,32)