[1-oxidanyl-2-(phenylcarbonyl)-3-piperidin-1-yl-phenanthren-4-yl] ethanoate

Systemtic Name: [1-oxidanyl-2-(phenylcarbonyl)-3-piperidin-1-yl-phenanthren-4-yl] ethanoate Openeye Name: [2-benzoyl-1-hydroxy-3-(1-piperidyl)-4-phenanthryl] acetate CAS Name: acetic acid [2-benzoyl-1-hydroxy-3-(1-piperidinyl)-4-phenanthrenyl] ester IUPAC Name: (2-benzoyl-1-hydroxy-3-piperidin-1-ylphenanthren-4-yl) acetate Traditional Name: acetic acid (2-benzoyl-1-hydroxy-3-piperidino-4-phenanthryl) ester Formula: C28H25NO4 MolecularWeight: 439.5024

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C(=C(C2=C1C3=CC=CC=C3C=C2)O)C(=O)C4=CC=CC=C4)N5CCCCC5

Isomeric SMILES

CC(=O)OC1=C(C(=C(C2=C1C3=CC=CC=C3C=C2)O)C(=O)C4=CC=CC=C4)N5CCCCC5

InChI

InChI=1S/C28H25NO4/c1-18(30)33-28-23-21-13-7-6-10-19(21)14-15-22(23)27(32)24(25(28)29-16-8-3-9-17-29)26(31)20-11-4-2-5-12-20/h2,4-7,10-15,32H,3,8-9,16-17H2,1H3