3-(3-methoxyphenoxy)-2-methyl-8-[(4-methylpiperazin-1-yl)methyl]-4-oxidanyl-5,6,8,8a-tetrahydrochromen-7-one

Systemtic Name: 3-(3-methoxyphenoxy)-2-methyl-8-[(4-methylpiperazin-1-yl)methyl]-4-oxidanyl-5,6,8,8a-tetrahydrochromen-7-one Openeye Name: 4-hydroxy-3-(3-methoxyphenoxy)-2-methyl-8-[(4-methylpiperazin-1-yl)methyl]-5,6,8,8a-tetrahydrochromen-7-one CAS Name: 4-hydroxy-3-(3-methoxyphenoxy)-2-methyl-8-[(4-methyl-1-piperazinyl)methyl]-5,6,8,8a-tetrahydro-1-benzopyran-7-one IUPAC Name: 4-hydroxy-3-(3-methoxyphenoxy)-2-methyl-8-[(4-methylpiperazin-1-yl)methyl]-5,6,8,8a-tetrahydrochromen-7-one Traditional Name: 4-hydroxy-3-(3-methoxyphenoxy)-2-methyl-8-[(4-methylpiperazino)methyl]-5,6,8,8a-tetrahydrochromen-7-one Formula: C23H30N2O5 MolecularWeight: 414.4947

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C2CCC(=O)C(C2O1)CN3CCN(CC3)C)O)OC4=CC(=CC=C4)OC

Isomeric SMILES

CC1=C(C(=C2CCC(=O)C(C2O1)CN3CCN(CC3)C)O)OC4=CC(=CC=C4)OC

InChI

InChI=1S/C23H30N2O5/c1-15-22(30-17-6-4-5-16(13-17)28-3)21(27)18-7-8-20(26)19(23(18)29-15)14-25-11-9-24(2)10-12-25/h4-6,13,19,23,27H,7-12,14H2,1-3H3