[4-[2-[(4-methoxyphenyl)amino]pyridin-3-yl]carbonylpiperazin-1-yl]-(9H-xanthen-9-yl)methanone

Systemtic Name: [4-[2-[(4-methoxyphenyl)amino]pyridin-3-yl]carbonylpiperazin-1-yl]-(9H-xanthen-9-yl)methanone Openeye Name: [4-[2-(4-methoxyanilino)pyridine-3-carbonyl]piperazin-1-yl]-(9H-xanthen-9-yl)methanone CAS Name: [4-[[2-(4-methoxyanilino)-3-pyridinyl]-oxomethyl]-1-piperazinyl]-(9H-xanthen-9-yl)methanone IUPAC Name: [4-[2-(4-methoxyanilino)pyridine-3-carbonyl]piperazin-1-yl]-(9H-xanthen-9-yl)methanone Traditional Name: [4-[2-(p-anisidino)nicotinoyl]piperazino]-(9H-xanthen-9-yl)methanone Formula: C31H28N4O4 MolecularWeight: 520.57842

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC2=C(C=CC=N2)C(=O)N3CCN(CC3)C(=O)C4C5=CC=CC=C5OC6=CC=CC=C46

Isomeric SMILES

COC1=CC=C(C=C1)NC2=C(C=CC=N2)C(=O)N3CCN(CC3)C(=O)C4C5=CC=CC=C5OC6=CC=CC=C46

InChI

InChI=1S/C31H28N4O4/c1-38-22-14-12-21(13-15-22)33-29-25(9-6-16-32-29)30(36)34-17-19-35(20-18-34)31(37)28-23-7-2-4-10-26(23)39-27-11-5-3-8-24(27)28/h2-16,28H,17-20H2,1H3,(H,32,33)