4-[4-(2-methoxyphenyl)piperazin-1-yl]-3-(pyrrolidin-1-ylmethyl)chromen-2-one

Systemtic Name: 4-[4-(2-methoxyphenyl)piperazin-1-yl]-3-(pyrrolidin-1-ylmethyl)chromen-2-one Openeye Name: 4-[4-(2-methoxyphenyl)piperazin-1-yl]-3-(pyrrolidin-1-ylmethyl)chromen-2-one CAS Name: 4-[4-(2-methoxyphenyl)-1-piperazinyl]-3-(1-pyrrolidinylmethyl)-1-benzopyran-2-one IUPAC Name: 4-[4-(2-methoxyphenyl)piperazin-1-yl]-3-(pyrrolidin-1-ylmethyl)chromen-2-one Traditional Name: 4-[4-(2-methoxyphenyl)piperazino]-3-(pyrrolidinomethyl)coumarin Formula: C25H29N3O3 MolecularWeight: 419.51606

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)C3=C(C(=O)OC4=CC=CC=C43)CN5CCCC5

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C3=C(C(=O)OC4=CC=CC=C43)CN5CCCC5

InChI

InChI=1S/C25H29N3O3/c1-30-23-11-5-3-9-21(23)27-14-16-28(17-15-27)24-19-8-2-4-10-22(19)31-25(29)20(24)18-26-12-6-7-13-26/h2-5,8-11H,6-7,12-18H2,1H3