4-[[4-(3,4-dimethoxyphenyl)carbonylpiperazin-1-yl]methyl]-7,8-dimethyl-chromen-2-one

Systemtic Name: 4-[[4-(3,4-dimethoxyphenyl)carbonylpiperazin-1-yl]methyl]-7,8-dimethyl-chromen-2-one Openeye Name: 4-[[4-(3,4-dimethoxybenzoyl)piperazin-1-yl]methyl]-7,8-dimethyl-chromen-2-one CAS Name: 4-[[4-[(3,4-dimethoxyphenyl)-oxomethyl]-1-piperazinyl]methyl]-7,8-dimethyl-1-benzopyran-2-one IUPAC Name: 4-[[4-(3,4-dimethoxybenzoyl)piperazin-1-yl]methyl]-7,8-dimethylchromen-2-one Traditional Name: 7,8-dimethyl-4-[(4-veratroylpiperazino)methyl]coumarin Formula: C25H28N2O5 MolecularWeight: 436.50022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=CC(=O)O2)CN3CCN(CC3)C(=O)C4=CC(=C(C=C4)OC)OC)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=CC(=O)O2)CN3CCN(CC3)C(=O)C4=CC(=C(C=C4)OC)OC)C

InChI

InChI=1S/C25H28N2O5/c1-16-5-7-20-19(14-23(28)32-24(20)17(16)2)15-26-9-11-27(12-10-26)25(29)18-6-8-21(30-3)22(13-18)31-4/h5-8,13-14H,9-12,15H2,1-4H3