6-methoxy-4-[[(4-methylphenyl)methyl-propyl-amino]methyl]chromen-2-one

Systemtic Name: 6-methoxy-4-[[(4-methylphenyl)methyl-propyl-amino]methyl]chromen-2-one Openeye Name: 6-methoxy-4-[[propyl(p-tolylmethyl)amino]methyl]chromen-2-one CAS Name: 6-methoxy-4-[[(4-methylphenyl)methyl-propylamino]methyl]-1-benzopyran-2-one IUPAC Name: 6-methoxy-4-[[(4-methylphenyl)methyl-propylamino]methyl]chromen-2-one Traditional Name: 6-methoxy-4-[[(4-methylbenzyl)-propyl-amino]methyl]coumarin Formula: C22H25NO3 MolecularWeight: 351.4388

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=CC=C(C=C1)C)CC2=CC(=O)OC3=C2C=C(C=C3)OC

Isomeric SMILES

CCCN(CC1=CC=C(C=C1)C)CC2=CC(=O)OC3=C2C=C(C=C3)OC

InChI

InChI=1S/C22H25NO3/c1-4-11-23(14-17-7-5-16(2)6-8-17)15-18-12-22(24)26-21-10-9-19(25-3)13-20(18)21/h5-10,12-13H,4,11,14-15H2,1-3H3