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

Systemtic Name: 4-[2-[4-(4-butoxyphenyl)carbonylpiperazin-1-yl]ethylamino]chromen-2-one Openeye Name: 4-[2-[4-(4-butoxybenzoyl)piperazin-1-yl]ethylamino]chromen-2-one CAS Name: 4-[2-[4-[(4-butoxyphenyl)-oxomethyl]-1-piperazinyl]ethylamino]-1-benzopyran-2-one IUPAC Name: 4-[2-[4-(4-butoxybenzoyl)piperazin-1-yl]ethylamino]chromen-2-one Traditional Name: 4-[2-[4-(4-butoxybenzoyl)piperazino]ethylamino]coumarin Formula: C26H31N3O4 MolecularWeight: 449.54204

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)N2CCN(CC2)CCNC3=CC(=O)OC4=CC=CC=C43

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)N2CCN(CC2)CCNC3=CC(=O)OC4=CC=CC=C43

InChI

InChI=1S/C26H31N3O4/c1-2-3-18-32-21-10-8-20(9-11-21)26(31)29-16-14-28(15-17-29)13-12-27-23-19-25(30)33-24-7-5-4-6-22(23)24/h4-11,19,27H,2-3,12-18H2,1H3