tert-butyl 2-acridin-9-yl-2-(1,3-benzodioxol-5-yl)ethanoate

Systemtic Name: tert-butyl 2-acridin-9-yl-2-(1,3-benzodioxol-5-yl)ethanoate Openeye Name: tert-butyl 2-acridin-9-yl-2-(1,3-benzodioxol-5-yl)acetate CAS Name: 2-(9-acridinyl)-2-(1,3-benzodioxol-5-yl)acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-acridin-9-yl-2-(1,3-benzodioxol-5-yl)acetate Traditional Name: 2-acridin-9-yl-2-(1,3-benzodioxol-5-yl)acetic acid tert-butyl ester Formula: C26H23NO4 MolecularWeight: 413.46512

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(C1=CC2=C(C=C1)OCO2)C3=C4C=CC=CC4=NC5=CC=CC=C53

Isomeric SMILES

CC(C)(C)OC(=O)C(C1=CC2=C(C=C1)OCO2)C3=C4C=CC=CC4=NC5=CC=CC=C53

InChI

InChI=1S/C26H23NO4/c1-26(2,3)31-25(28)23(16-12-13-21-22(14-16)30-15-29-21)24-17-8-4-6-10-19(17)27-20-11-7-5-9-18(20)24/h4-14,23H,15H2,1-3H3