3-[[4-(3,4-dimethoxyphenyl)-4-oxidanylidene-butanoyl]amino]-4-pyrrolidin-1-yl-benzamide

Systemtic Name: 3-[[4-(3,4-dimethoxyphenyl)-4-oxidanylidene-butanoyl]amino]-4-pyrrolidin-1-yl-benzamide Openeye Name: 3-[[4-(3,4-dimethoxyphenyl)-4-oxo-butanoyl]amino]-4-pyrrolidin-1-yl-benzamide CAS Name: 3-[[4-(3,4-dimethoxyphenyl)-1,4-dioxobutyl]amino]-4-(1-pyrrolidinyl)benzamide IUPAC Name: 3-[[4-(3,4-dimethoxyphenyl)-4-oxobutanoyl]amino]-4-pyrrolidin-1-ylbenzamide Traditional Name: 3-[[4-(3,4-dimethoxyphenyl)-4-keto-butanoyl]amino]-4-pyrrolidino-benzamide Formula: C23H27N3O5 MolecularWeight: 425.47758

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)CCC(=O)NC2=C(C=CC(=C2)C(=O)N)N3CCCC3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)CCC(=O)NC2=C(C=CC(=C2)C(=O)N)N3CCCC3)OC

InChI

InChI=1S/C23H27N3O5/c1-30-20-9-6-15(14-21(20)31-2)19(27)8-10-22(28)25-17-13-16(23(24)29)5-7-18(17)26-11-3-4-12-26/h5-7,9,13-14H,3-4,8,10-12H2,1-2H3,(H2,24,29)(H,25,28)