1-[2-[3-(diethylaminomethyl)-4-oxidanyl-phenyl]-3-ethanoyl-2H-perimidin-1-yl]ethanone

Systemtic Name: 1-[2-[3-(diethylaminomethyl)-4-oxidanyl-phenyl]-3-ethanoyl-2H-perimidin-1-yl]ethanone Openeye Name: 1-[3-acetyl-2-[3-(diethylaminomethyl)-4-hydroxy-phenyl]-2H-perimidin-1-yl]ethanone CAS Name: 1-[3-acetyl-2-[3-(diethylaminomethyl)-4-hydroxyphenyl]-2H-perimidin-1-yl]ethanone IUPAC Name: 1-[3-acetyl-2-[3-(diethylaminomethyl)-4-hydroxyphenyl]-2H-perimidin-1-yl]ethanone Traditional Name: 1-[3-acetyl-2-[3-(diethylaminomethyl)-4-hydroxy-phenyl]-2H-perimidin-1-yl]ethanone Formula: C26H29N3O3 MolecularWeight: 431.52676

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=C(C=CC(=C1)C2N(C3=CC=CC4=C3C(=CC=C4)N2C(=O)C)C(=O)C)O

Isomeric SMILES

CCN(CC)CC1=C(C=CC(=C1)C2N(C3=CC=CC4=C3C(=CC=C4)N2C(=O)C)C(=O)C)O

InChI

InChI=1S/C26H29N3O3/c1-5-27(6-2)16-21-15-20(13-14-24(21)32)26-28(17(3)30)22-11-7-9-19-10-8-12-23(25(19)22)29(26)18(4)31/h7-15,26,32H,5-6,16H2,1-4H3