3-[4-(3,5-dimethylphenyl)piperazin-1-yl]carbonyl-8-prop-2-enyl-chromen-2-one

Systemtic Name: 3-[4-(3,5-dimethylphenyl)piperazin-1-yl]carbonyl-8-prop-2-enyl-chromen-2-one Openeye Name: 8-allyl-3-[4-(3,5-dimethylphenyl)piperazine-1-carbonyl]chromen-2-one CAS Name: 3-[[4-(3,5-dimethylphenyl)-1-piperazinyl]-oxomethyl]-8-prop-2-enyl-1-benzopyran-2-one IUPAC Name: 3-[4-(3,5-dimethylphenyl)piperazine-1-carbonyl]-8-prop-2-enylchromen-2-one Traditional Name: 8-allyl-3-[4-(3,5-dimethylphenyl)piperazine-1-carbonyl]coumarin Formula: C25H26N2O3 MolecularWeight: 402.48554

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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