3-(1,3-benzodioxol-5-yl)-1-(4-ethanoylpiperazin-1-yl)-3-(1-methylindol-3-yl)propan-1-one

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-1-(4-ethanoylpiperazin-1-yl)-3-(1-methylindol-3-yl)propan-1-one Openeye Name: 1-(4-acetylpiperazin-1-yl)-3-(1,3-benzodioxol-5-yl)-3-(1-methylindol-3-yl)propan-1-one CAS Name: 1-(4-acetyl-1-piperazinyl)-3-(1,3-benzodioxol-5-yl)-3-(1-methyl-3-indolyl)-1-propanone IUPAC Name: 1-(4-acetylpiperazin-1-yl)-3-(1,3-benzodioxol-5-yl)-3-(1-methylindol-3-yl)propan-1-one Traditional Name: 1-(4-acetylpiperazino)-3-(1,3-benzodioxol-5-yl)-3-(1-methylindol-3-yl)propan-1-one Formula: C25H27N3O4 MolecularWeight: 433.49958

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C(=O)CC(C2=CC3=C(C=C2)OCO3)C4=CN(C5=CC=CC=C54)C

Isomeric SMILES

CC(=O)N1CCN(CC1)C(=O)CC(C2=CC3=C(C=C2)OCO3)C4=CN(C5=CC=CC=C54)C

InChI

InChI=1S/C25H27N3O4/c1-17(29)27-9-11-28(12-10-27)25(30)14-20(18-7-8-23-24(13-18)32-16-31-23)21-15-26(2)22-6-4-3-5-19(21)22/h3-8,13,15,20H,9-12,14,16H2,1-2H3