1-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazin-1-yl]-4-(7-methyl-1H-indol-3-yl)butan-1-one

Systemtic Name: 1-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazin-1-yl]-4-(7-methyl-1H-indol-3-yl)butan-1-one Openeye Name: 1-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazin-1-yl]-4-(7-methyl-1H-indol-3-yl)butan-1-one CAS Name: 1-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)-1-piperazinyl]-4-(7-methyl-1H-indol-3-yl)-1-butanone IUPAC Name: 1-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazin-1-yl]-4-(7-methyl-1H-indol-3-yl)butan-1-one Traditional Name: 1-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazino]-4-(7-methyl-1H-indol-3-yl)butan-1-one Formula: C25H29N3O3 MolecularWeight: 419.51606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1NC=C2CCCC(=O)N3CCN(CC3)C4=C5C(=CC=C4)OCCO5

Isomeric SMILES

CC1=CC=CC2=C1NC=C2CCCC(=O)N3CCN(CC3)C4=C5C(=CC=C4)OCCO5

InChI

InChI=1S/C25H29N3O3/c1-18-5-2-7-20-19(17-26-24(18)20)6-3-10-23(29)28-13-11-27(12-14-28)21-8-4-9-22-25(21)31-16-15-30-22/h2,4-5,7-9,17,26H,3,6,10-16H2,1H3