4-butyl-7-oxidanyl-8-[[(4-phenylmethoxyphenyl)amino]methyl]chromen-2-one

Systemtic Name: 4-butyl-7-oxidanyl-8-[[(4-phenylmethoxyphenyl)amino]methyl]chromen-2-one Openeye Name: 8-[(4-benzyloxyanilino)methyl]-4-butyl-7-hydroxy-chromen-2-one CAS Name: 4-butyl-7-hydroxy-8-[(4-phenylmethoxyanilino)methyl]-1-benzopyran-2-one IUPAC Name: 4-butyl-7-hydroxy-8-[(4-phenylmethoxyanilino)methyl]chromen-2-one Traditional Name: 8-[(4-benzoxyanilino)methyl]-4-butyl-7-hydroxy-coumarin Formula: C27H27NO4 MolecularWeight: 429.50758

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=O)OC2=C1C=CC(=C2CNC3=CC=C(C=C3)OCC4=CC=CC=C4)O

Isomeric SMILES

CCCCC1=CC(=O)OC2=C1C=CC(=C2CNC3=CC=C(C=C3)OCC4=CC=CC=C4)O

InChI

InChI=1S/C27H27NO4/c1-2-3-9-20-16-26(30)32-27-23(20)14-15-25(29)24(27)17-28-21-10-12-22(13-11-21)31-18-19-7-5-4-6-8-19/h4-8,10-16,28-29H,2-3,9,17-18H2,1H3