4-[2-[4-(3-iodanylphenyl)carbonylpiperazin-1-yl]ethylamino]chromen-2-one

Systemtic Name: 4-[2-[4-(3-iodanylphenyl)carbonylpiperazin-1-yl]ethylamino]chromen-2-one Openeye Name: 4-[2-[4-(3-iodobenzoyl)piperazin-1-yl]ethylamino]chromen-2-one CAS Name: 4-[2-[4-[(3-iodophenyl)-oxomethyl]-1-piperazinyl]ethylamino]-1-benzopyran-2-one IUPAC Name: 4-[2-[4-(3-iodobenzoyl)piperazin-1-yl]ethylamino]chromen-2-one Traditional Name: 4-[2-[4-(3-iodobenzoyl)piperazino]ethylamino]coumarin Formula: C22H22IN3O3 MolecularWeight: 503.33285

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22IN3O3/c23-17-5-3-4-16(14-17)22(28)26-12-10-25(11-13-26)9-8-24-19-15-21(27)29-20-7-2-1-6-18(19)20/h1-7,14-15,24H,8-13H2