N-[2-[4-(phenylmethyl)piperazin-1-yl]-2-pyridin-3-yl-ethyl]-9H-xanthene-9-carboxamide

Systemtic Name: N-[2-[4-(phenylmethyl)piperazin-1-yl]-2-pyridin-3-yl-ethyl]-9H-xanthene-9-carboxamide Openeye Name: N-[2-(4-benzylpiperazin-1-yl)-2-(3-pyridyl)ethyl]-9H-xanthene-9-carboxamide CAS Name: N-[2-[4-(phenylmethyl)-1-piperazinyl]-2-(3-pyridinyl)ethyl]-9H-xanthene-9-carboxamide IUPAC Name: N-[2-(4-benzylpiperazin-1-yl)-2-pyridin-3-ylethyl]-9H-xanthene-9-carboxamide Traditional Name: N-[2-(4-benzylpiperazino)-2-(3-pyridyl)ethyl]-9H-xanthene-9-carboxamide Formula: C32H32N4O2 MolecularWeight: 504.62208

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(CNC(=O)C3C4=CC=CC=C4OC5=CC=CC=C35)C6=CN=CC=C6

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(CNC(=O)C3C4=CC=CC=C4OC5=CC=CC=C35)C6=CN=CC=C6

InChI

InChI=1S/C32H32N4O2/c37-32(31-26-12-4-6-14-29(26)38-30-15-7-5-13-27(30)31)34-22-28(25-11-8-16-33-21-25)36-19-17-35(18-20-36)23-24-9-2-1-3-10-24/h1-16,21,28,31H,17-20,22-23H2,(H,34,37)