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

Systemtic Name: 4-[(3,4-dimethylphenyl)methyl-piperidin-4-yl-amino]-6-ethyl-chromen-2-one Openeye Name: 4-[(3,4-dimethylphenyl)methyl-(4-piperidyl)amino]-6-ethyl-chromen-2-one CAS Name: 4-[(3,4-dimethylphenyl)methyl-(4-piperidinyl)amino]-6-ethyl-1-benzopyran-2-one IUPAC Name: 4-[(3,4-dimethylphenyl)methyl-piperidin-4-ylamino]-6-ethylchromen-2-one Traditional Name: 4-[(3,4-dimethylbenzyl)-(4-piperidyl)amino]-6-ethyl-coumarin Formula: C25H30N2O2 MolecularWeight: 390.5179

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)OC(=O)C=C2N(CC3=CC(=C(C=C3)C)C)C4CCNCC4

Isomeric SMILES

CCC1=CC2=C(C=C1)OC(=O)C=C2N(CC3=CC(=C(C=C3)C)C)C4CCNCC4

InChI

InChI=1S/C25H30N2O2/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/h5-8,13-15,21,26H,4,9-12,16H2,1-3H3