4-(4-methylpiperazin-1-yl)-1-[7-[4-(4-methylpiperazin-1-yl)butanoyl]-9H-xanthen-2-yl]butan-1-one

Systemtic Name: 4-(4-methylpiperazin-1-yl)-1-[7-[4-(4-methylpiperazin-1-yl)butanoyl]-9H-xanthen-2-yl]butan-1-one Openeye Name: 4-(4-methylpiperazin-1-yl)-1-[7-[4-(4-methylpiperazin-1-yl)butanoyl]-9H-xanthen-2-yl]butan-1-one CAS Name: 4-(4-methyl-1-piperazinyl)-1-[7-[4-(4-methyl-1-piperazinyl)-1-oxobutyl]-9H-xanthen-2-yl]-1-butanone IUPAC Name: 4-(4-methylpiperazin-1-yl)-1-[7-[4-(4-methylpiperazin-1-yl)butanoyl]-9H-xanthen-2-yl]butan-1-one Traditional Name: 4-(4-methylpiperazino)-1-[7-[4-(4-methylpiperazino)butanoyl]-9H-xanthen-2-yl]butan-1-one Formula: C31H42N4O3 MolecularWeight: 518.69018

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCCC(=O)C2=CC3=C(C=C2)OC4=C(C3)C=C(C=C4)C(=O)CCCN5CCN(CC5)C

Isomeric SMILES

CN1CCN(CC1)CCCC(=O)C2=CC3=C(C=C2)OC4=C(C3)C=C(C=C4)C(=O)CCCN5CCN(CC5)C

InChI

InChI=1S/C31H42N4O3/c1-32-13-17-34(18-14-32)11-3-5-28(36)24-7-9-30-26(21-24)23-27-22-25(8-10-31(27)38-30)29(37)6-4-12-35-19-15-33(2)16-20-35/h7-10,21-22H,3-6,11-20,23H2,1-2H3