4-[(3,4-dimethylphenyl)methyl-piperidin-4-yl-amino]-6-ethenyl-chromen-2-one

Systemtic Name: 4-[(3,4-dimethylphenyl)methyl-piperidin-4-yl-amino]-6-ethenyl-chromen-2-one Openeye Name: 4-[(3,4-dimethylphenyl)methyl-(4-piperidyl)amino]-6-vinyl-chromen-2-one CAS Name: 4-[(3,4-dimethylphenyl)methyl-(4-piperidinyl)amino]-6-ethenyl-1-benzopyran-2-one IUPAC Name: 4-[(3,4-dimethylphenyl)methyl-piperidin-4-ylamino]-6-ethenylchromen-2-one Traditional Name: 4-[(3,4-dimethylbenzyl)-(4-piperidyl)amino]-6-vinyl-coumarin Formula: C25H28N2O2 MolecularWeight: 388.50202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CN(C2CCNCC2)C3=CC(=O)OC4=C3C=C(C=C4)C=C)C

Isomeric SMILES

CC1=C(C=C(C=C1)CN(C2CCNCC2)C3=CC(=O)OC4=C3C=C(C=C4)C=C)C

InChI

InChI=1S/C25H28N2O2/c1-4-19-7-8-24-22(14-19)23(15-25(28)29-24)27(21-9-11-26-12-10-21)16-20-6-5-17(2)18(3)13-20/h4-8,13-15,21,26H,1,9-12,16H2,2-3H3