[3-acetyloxy-4-(5,6-dihydrophenanthridin-6-yl)-2,2,4-trimethyl-pentyl] ethanoate

Systemtic Name: [3-acetyloxy-4-(5,6-dihydrophenanthridin-6-yl)-2,2,4-trimethyl-pentyl] ethanoate Openeye Name: [3-acetoxy-4-(5,6-dihydrophenanthridin-6-yl)-2,2,4-trimethyl-pentyl] acetate CAS Name: acetic acid [3-acetyloxy-4-(5,6-dihydrophenanthridin-6-yl)-2,2,4-trimethylpentyl] ester IUPAC Name: [3-acetyloxy-4-(5,6-dihydrophenanthridin-6-yl)-2,2,4-trimethylpentyl] acetate Traditional Name: acetic acid [3-acetoxy-4-(5,6-dihydrophenanthridin-6-yl)-2,2,4-trimethyl-pentyl] ester Formula: C25H31NO4 MolecularWeight: 409.51794

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(C)(C)C(C(C)(C)C1C2=CC=CC=C2C3=CC=CC=C3N1)OC(=O)C

Isomeric SMILES

CC(=O)OCC(C)(C)C(C(C)(C)C1C2=CC=CC=C2C3=CC=CC=C3N1)OC(=O)C

InChI

InChI=1S/C25H31NO4/c1-16(27)29-15-24(3,4)23(30-17(2)28)25(5,6)22-20-13-8-7-11-18(20)19-12-9-10-14-21(19)26-22/h7-14,22-23,26H,15H2,1-6H3