9,9a-dihydro-4aH-xanthen-9-yl-[4-(3-methoxyphenyl)piperazin-1-yl]methanone

Systemtic Name: 9,9a-dihydro-4aH-xanthen-9-yl-[4-(3-methoxyphenyl)piperazin-1-yl]methanone Openeye Name: 9,9a-dihydro-4aH-xanthen-9-yl-[4-(3-methoxyphenyl)piperazin-1-yl]methanone CAS Name: 9,9a-dihydro-4aH-xanthen-9-yl-[4-(3-methoxyphenyl)-1-piperazinyl]methanone IUPAC Name: 9,9a-dihydro-4aH-xanthen-9-yl-[4-(3-methoxyphenyl)piperazin-1-yl]methanone Traditional Name: 9,9a-dihydro-4aH-xanthen-9-yl-[4-(3-methoxyphenyl)piperazino]methanone Formula: C25H26N2O3 MolecularWeight: 402.48554

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CCN(CC2)C(=O)C3C4C=CC=CC4OC5=CC=CC=C35

Isomeric SMILES

COC1=CC=CC(=C1)N2CCN(CC2)C(=O)C3C4C=CC=CC4OC5=CC=CC=C35

InChI

InChI=1S/C25H26N2O3/c1-29-19-8-6-7-18(17-19)26-13-15-27(16-14-26)25(28)24-20-9-2-4-11-22(20)30-23-12-5-3-10-21(23)24/h2-12,17,20,22,24H,13-16H2,1H3