4-methyl-7-[[4-(4-phenylpiperazin-1-yl)carbonylphenyl]methoxy]chromen-2-one

Systemtic Name: 4-methyl-7-[[4-(4-phenylpiperazin-1-yl)carbonylphenyl]methoxy]chromen-2-one Openeye Name: 4-methyl-7-[[4-(4-phenylpiperazine-1-carbonyl)phenyl]methoxy]chromen-2-one CAS Name: 4-methyl-7-[[4-[oxo-(4-phenyl-1-piperazinyl)methyl]phenyl]methoxy]-1-benzopyran-2-one IUPAC Name: 4-methyl-7-[[4-(4-phenylpiperazine-1-carbonyl)phenyl]methoxy]chromen-2-one Traditional Name: 4-methyl-7-[4-(4-phenylpiperazine-1-carbonyl)benzyl]oxy-coumarin Formula: C28H26N2O4 MolecularWeight: 454.51704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)OCC3=CC=C(C=C3)C(=O)N4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)OCC3=CC=C(C=C3)C(=O)N4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C28H26N2O4/c1-20-17-27(31)34-26-18-24(11-12-25(20)26)33-19-21-7-9-22(10-8-21)28(32)30-15-13-29(14-16-30)23-5-3-2-4-6-23/h2-12,17-18H,13-16,19H2,1H3