(2-azanyl-2-methyl-propyl) 6-[1-(phenylmethyl)-2,3-dihydroindol-7-yl]-1,3-benzodioxole-5-carboxylate

Systemtic Name: (2-azanyl-2-methyl-propyl) 6-[1-(phenylmethyl)-2,3-dihydroindol-7-yl]-1,3-benzodioxole-5-carboxylate Openeye Name: (2-amino-2-methyl-propyl) 6-(1-benzylindolin-7-yl)-1,3-benzodioxole-5-carboxylate CAS Name: 6-[1-(phenylmethyl)-2,3-dihydroindol-7-yl]-1,3-benzodioxole-5-carboxylic acid (2-amino-2-methylpropyl) ester IUPAC Name: (2-amino-2-methylpropyl) 6-(1-benzyl-2,3-dihydroindol-7-yl)-1,3-benzodioxole-5-carboxylate Traditional Name: 6-(1-benzylindolin-7-yl)-piperonylic acid (2-amino-2-methyl-propyl) ester Formula: C27H28N2O4 MolecularWeight: 444.52222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(COC(=O)C1=CC2=C(C=C1C3=C4C(=CC=C3)CCN4CC5=CC=CC=C5)OCO2)N

Isomeric SMILES

CC(C)(COC(=O)C1=CC2=C(C=C1C3=C4C(=CC=C3)CCN4CC5=CC=CC=C5)OCO2)N

InChI

InChI=1S/C27H28N2O4/c1-27(2,28)16-31-26(30)22-14-24-23(32-17-33-24)13-21(22)20-10-6-9-19-11-12-29(25(19)20)15-18-7-4-3-5-8-18/h3-10,13-14H,11-12,15-17,28H2,1-2H3