4-[2-[4-(2,4-dichlorophenyl)carbonylpiperazin-1-yl]ethylamino]chromen-2-one

Systemtic Name: 4-[2-[4-(2,4-dichlorophenyl)carbonylpiperazin-1-yl]ethylamino]chromen-2-one Openeye Name: 4-[2-[4-(2,4-dichlorobenzoyl)piperazin-1-yl]ethylamino]chromen-2-one CAS Name: 4-[2-[4-[(2,4-dichlorophenyl)-oxomethyl]-1-piperazinyl]ethylamino]-1-benzopyran-2-one IUPAC Name: 4-[2-[4-(2,4-dichlorobenzoyl)piperazin-1-yl]ethylamino]chromen-2-one Traditional Name: 4-[2-[4-(2,4-dichlorobenzoyl)piperazino]ethylamino]coumarin Formula: C22H21Cl2N3O3 MolecularWeight: 446.32644

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCNC2=CC(=O)OC3=CC=CC=C32)C(=O)C4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

C1CN(CCN1CCNC2=CC(=O)OC3=CC=CC=C32)C(=O)C4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C22H21Cl2N3O3/c23-15-5-6-16(18(24)13-15)22(29)27-11-9-26(10-12-27)8-7-25-19-14-21(28)30-20-4-2-1-3-17(19)20/h1-6,13-14,25H,7-12H2