4-[[(2,3-dimethylcyclohexyl)amino]methyl]-7-ethyl-chromen-2-one

Systemtic Name: 4-[[(2,3-dimethylcyclohexyl)amino]methyl]-7-ethyl-chromen-2-one Openeye Name: 4-[[(2,3-dimethylcyclohexyl)amino]methyl]-7-ethyl-chromen-2-one CAS Name: 4-[[(2,3-dimethylcyclohexyl)amino]methyl]-7-ethyl-1-benzopyran-2-one IUPAC Name: 4-[[(2,3-dimethylcyclohexyl)amino]methyl]-7-ethylchromen-2-one Traditional Name: 4-[[(2,3-dimethylcyclohexyl)amino]methyl]-7-ethyl-coumarin Formula: C20H27NO2 MolecularWeight: 313.43388

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CC(=O)O2)CNC3CCCC(C3C)C

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CC(=O)O2)CNC3CCCC(C3C)C

InChI

InChI=1S/C20H27NO2/c1-4-15-8-9-17-16(11-20(22)23-19(17)10-15)12-21-18-7-5-6-13(2)14(18)3/h8-11,13-14,18,21H,4-7,12H2,1-3H3