8-[[(4-methoxyphenyl)methyl-phenethyl-amino]methyl]-7-oxidanyl-2-[(E)-2-thiophen-2-ylethenyl]chromen-4-one

Systemtic Name: 8-[[(4-methoxyphenyl)methyl-phenethyl-amino]methyl]-7-oxidanyl-2-[(E)-2-thiophen-2-ylethenyl]chromen-4-one Openeye Name: 7-hydroxy-8-[[(4-methoxyphenyl)methyl-phenethyl-amino]methyl]-2-[(E)-2-(2-thienyl)vinyl]chromen-4-one CAS Name: 7-hydroxy-8-[[(4-methoxyphenyl)methyl-phenethylamino]methyl]-2-[(E)-2-thiophen-2-ylethenyl]-1-benzopyran-4-one IUPAC Name: 7-hydroxy-8-[[(4-methoxyphenyl)methyl-phenethylamino]methyl]-2-[(E)-2-thiophen-2-ylethenyl]chromen-4-one Traditional Name: 7-hydroxy-8-[[p-anisyl(phenethyl)amino]methyl]-2-[(E)-2-(2-thienyl)vinyl]chromone Formula: C32H29NO4S MolecularWeight: 523.64196

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN(CCC2=CC=CC=C2)CC3=C(C=CC4=C3OC(=CC4=O)C=CC5=CC=CS5)O

Isomeric SMILES

COC1=CC=C(C=C1)CN(CCC2=CC=CC=C2)CC3=C(C=CC4=C3OC(=CC4=O)/C=C/C5=CC=CS5)O

InChI

InChI=1S/C32H29NO4S/c1-36-25-11-9-24(10-12-25)21-33(18-17-23-6-3-2-4-7-23)22-29-30(34)16-15-28-31(35)20-26(37-32(28)29)13-14-27-8-5-19-38-27/h2-16,19-20,34H,17-18,21-22H2,1H3/b14-13+