3-[4-(2,6-dimethylphenyl)piperazin-1-yl]carbonyl-8-prop-2-enyl-chromen-2-one

Systemtic Name: 3-[4-(2,6-dimethylphenyl)piperazin-1-yl]carbonyl-8-prop-2-enyl-chromen-2-one Openeye Name: 8-allyl-3-[4-(2,6-dimethylphenyl)piperazine-1-carbonyl]chromen-2-one CAS Name: 3-[[4-(2,6-dimethylphenyl)-1-piperazinyl]-oxomethyl]-8-prop-2-enyl-1-benzopyran-2-one IUPAC Name: 3-[4-(2,6-dimethylphenyl)piperazine-1-carbonyl]-8-prop-2-enylchromen-2-one Traditional Name: 8-allyl-3-[4-(2,6-dimethylphenyl)piperazine-1-carbonyl]coumarin Formula: C25H26N2O3 MolecularWeight: 402.48554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N2CCN(CC2)C(=O)C3=CC4=C(C(=CC=C4)CC=C)OC3=O

Isomeric SMILES

CC1=C(C(=CC=C1)C)N2CCN(CC2)C(=O)C3=CC4=C(C(=CC=C4)CC=C)OC3=O

InChI

InChI=1S/C25H26N2O3/c1-4-7-19-10-6-11-20-16-21(25(29)30-23(19)20)24(28)27-14-12-26(13-15-27)22-17(2)8-5-9-18(22)3/h4-6,8-11,16H,1,7,12-15H2,2-3H3