1-[4-(1,3-benzodioxol-5-yl)-5-ethanoyl-2,6-bis(phenylazanyl)-1,4-dihydropyridin-3-yl]ethanone

Systemtic Name: 1-[4-(1,3-benzodioxol-5-yl)-5-ethanoyl-2,6-bis(phenylazanyl)-1,4-dihydropyridin-3-yl]ethanone Openeye Name: 1-[5-acetyl-2,6-dianilino-4-(1,3-benzodioxol-5-yl)-1,4-dihydropyridin-3-yl]ethanone CAS Name: 1-[5-acetyl-2,6-dianilino-4-(1,3-benzodioxol-5-yl)-1,4-dihydropyridin-3-yl]ethanone IUPAC Name: 1-[5-acetyl-2,6-dianilino-4-(1,3-benzodioxol-5-yl)-1,4-dihydropyridin-3-yl]ethanone Traditional Name: 1-[5-acetyl-2,6-dianilino-4-(1,3-benzodioxol-5-yl)-1,4-dihydropyridin-3-yl]ethanone Formula: C28H25N3O4 MolecularWeight: 467.5158

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(NC(=C(C1C2=CC3=C(C=C2)OCO3)C(=O)C)NC4=CC=CC=C4)NC5=CC=CC=C5

Isomeric SMILES

CC(=O)C1=C(NC(=C(C1C2=CC3=C(C=C2)OCO3)C(=O)C)NC4=CC=CC=C4)NC5=CC=CC=C5

InChI

InChI=1S/C28H25N3O4/c1-17(32)24-26(19-13-14-22-23(15-19)35-16-34-22)25(18(2)33)28(30-21-11-7-4-8-12-21)31-27(24)29-20-9-5-3-6-10-20/h3-15,26,29-31H,16H2,1-2H3