N,N-diethyl-9-[1-(1H-imidazol-2-ylmethyl)piperidin-4-yl]-9H-xanthene-3-carboxamide

Systemtic Name: N,N-diethyl-9-[1-(1H-imidazol-2-ylmethyl)piperidin-4-yl]-9H-xanthene-3-carboxamide Openeye Name: N,N-diethyl-9-[1-(1H-imidazol-2-ylmethyl)-4-piperidyl]-9H-xanthene-3-carboxamide CAS Name: N,N-diethyl-9-[1-(1H-imidazol-2-ylmethyl)-4-piperidinyl]-9H-xanthene-3-carboxamide IUPAC Name: N,N-diethyl-9-[1-(1H-imidazol-2-ylmethyl)piperidin-4-yl]-9H-xanthene-3-carboxamide Traditional Name: N,N-diethyl-9-[1-(1H-imidazol-2-ylmethyl)-4-piperidyl]-9H-xanthene-3-carboxamide Formula: C27H32N4O2 MolecularWeight: 444.56858

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC2=C(C=C1)C(C3=CC=CC=C3O2)C4CCN(CC4)CC5=NC=CN5

Isomeric SMILES

CCN(CC)C(=O)C1=CC2=C(C=C1)C(C3=CC=CC=C3O2)C4CCN(CC4)CC5=NC=CN5

InChI

InChI=1S/C27H32N4O2/c1-3-31(4-2)27(32)20-9-10-22-24(17-20)33-23-8-6-5-7-21(23)26(22)19-11-15-30(16-12-19)18-25-28-13-14-29-25/h5-10,13-14,17,19,26H,3-4,11-12,15-16,18H2,1-2H3,(H,28,29)