3-[4-(2-methoxyphenyl)piperazin-1-yl]-1-propyl-9H-xanthene-9-carboxamide

Systemtic Name: 3-[4-(2-methoxyphenyl)piperazin-1-yl]-1-propyl-9H-xanthene-9-carboxamide Openeye Name: 3-[4-(2-methoxyphenyl)piperazin-1-yl]-1-propyl-9H-xanthene-9-carboxamide CAS Name: 3-[4-(2-methoxyphenyl)-1-piperazinyl]-1-propyl-9H-xanthene-9-carboxamide IUPAC Name: 3-[4-(2-methoxyphenyl)piperazin-1-yl]-1-propyl-9H-xanthene-9-carboxamide Traditional Name: 3-[4-(2-methoxyphenyl)piperazino]-1-propyl-9H-xanthene-9-carboxamide Formula: C28H31N3O3 MolecularWeight: 457.56404

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=CC2=C1C(C3=CC=CC=C3O2)C(=O)N)N4CCN(CC4)C5=CC=CC=C5OC

Isomeric SMILES

CCCC1=CC(=CC2=C1C(C3=CC=CC=C3O2)C(=O)N)N4CCN(CC4)C5=CC=CC=C5OC

InChI

InChI=1S/C28H31N3O3/c1-3-8-19-17-20(30-13-15-31(16-14-30)22-10-5-7-12-24(22)33-2)18-25-26(19)27(28(29)32)21-9-4-6-11-23(21)34-25/h4-7,9-12,17-18,27H,3,8,13-16H2,1-2H3,(H2,29,32)