8-[[(3,5-dimethylphenyl)amino]methyl]-4-methyl-7-oxidanyl-3-(phenylmethyl)chromen-2-one

Systemtic Name: 8-[[(3,5-dimethylphenyl)amino]methyl]-4-methyl-7-oxidanyl-3-(phenylmethyl)chromen-2-one Openeye Name: 3-benzyl-8-[(3,5-dimethylanilino)methyl]-7-hydroxy-4-methyl-chromen-2-one CAS Name: 8-[(3,5-dimethylanilino)methyl]-7-hydroxy-4-methyl-3-(phenylmethyl)-1-benzopyran-2-one IUPAC Name: 3-benzyl-8-[(3,5-dimethylanilino)methyl]-7-hydroxy-4-methylchromen-2-one Traditional Name: 3-benzyl-8-[(3,5-dimethylanilino)methyl]-7-hydroxy-4-methyl-coumarin Formula: C26H25NO3 MolecularWeight: 399.4816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NCC2=C(C=CC3=C2OC(=O)C(=C3C)CC4=CC=CC=C4)O)C

Isomeric SMILES

CC1=CC(=CC(=C1)NCC2=C(C=CC3=C2OC(=O)C(=C3C)CC4=CC=CC=C4)O)C

InChI

InChI=1S/C26H25NO3/c1-16-11-17(2)13-20(12-16)27-15-23-24(28)10-9-21-18(3)22(26(29)30-25(21)23)14-19-7-5-4-6-8-19/h4-13,27-28H,14-15H2,1-3H3