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

Systemtic Name: 2-[[2-[[(3,4-dichlorophenyl)methylamino]methyl]-3-oxidanyl-propyl]amino]-1H-quinolin-4-one Openeye Name: 2-[[2-[[(3,4-dichlorophenyl)methylamino]methyl]-3-hydroxy-propyl]amino]-1H-quinolin-4-one CAS Name: 2-[[2-[[(3,4-dichlorophenyl)methylamino]methyl]-3-hydroxypropyl]amino]-1H-quinolin-4-one IUPAC Name: 2-[[2-[[(3,4-dichlorophenyl)methylamino]methyl]-3-hydroxypropyl]amino]-1H-quinolin-4-one Traditional Name: 2-[[2-[[(3,4-dichlorobenzyl)amino]methyl]-3-hydroxy-propyl]amino]-4-quinolone Formula: C20H21Cl2N3O2 MolecularWeight: 406.30564

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C=C(N2)NCC(CNCC3=CC(=C(C=C3)Cl)Cl)CO

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C=C(N2)NCC(CNCC3=CC(=C(C=C3)Cl)Cl)CO

InChI

InChI=1S/C20H21Cl2N3O2/c21-16-6-5-13(7-17(16)22)9-23-10-14(12-26)11-24-20-8-19(27)15-3-1-2-4-18(15)25-20/h1-8,14,23,26H,9-12H2,(H2,24,25,27)