2-[3-(4-azanylphenoxy)propyl]isoindole-1,3-dione; methanesulfonic acid

Systemtic Name: 2-[3-(4-azanylphenoxy)propyl]isoindole-1,3-dione; methanesulfonic acid Openeye Name: 2-[3-(4-aminophenoxy)propyl]isoindoline-1,3-dione; methanesulfonic acid CAS Name: 2-[3-(4-aminophenoxy)propyl]isoindole-1,3-dione; methanesulfonic acid IUPAC Name: 2-[3-(4-aminophenoxy)propyl]isoindole-1,3-dione; methanesulfonic acid Traditional Name: 2-[3-(4-aminophenoxy)propyl]isoindoline-1,3-quinone; mesylic acid Formula: C18H20N2O6S MolecularWeight: 392.4262

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)O.C1=CC=C2C(=C1)C(=O)N(C2=O)CCCOC3=CC=C(C=C3)N

Isomeric SMILES

CS(=O)(=O)O.C1=CC=C2C(=C1)C(=O)N(C2=O)CCCOC3=CC=C(C=C3)N

InChI

InChI=1S/C17H16N2O3.CH4O3S/c18-12-6-8-13(9-7-12)22-11-3-10-19-16(20)14-4-1-2-5-15(14)17(19)21;1-5(2,3)4/h1-2,4-9H,3,10-11,18H2;1H3,(H,2,3,4)