3-(1-azanylethyl)-6-butoxy-2-(2,2-diethoxyethyl)-3H-isoindol-1-one

Systemtic Name: 3-(1-azanylethyl)-6-butoxy-2-(2,2-diethoxyethyl)-3H-isoindol-1-one Openeye Name: 3-(1-aminoethyl)-6-butoxy-2-(2,2-diethoxyethyl)isoindolin-1-one CAS Name: 3-(1-aminoethyl)-6-butoxy-2-(2,2-diethoxyethyl)-3H-isoindol-1-one IUPAC Name: 3-(1-aminoethyl)-6-butoxy-2-(2,2-diethoxyethyl)-3H-isoindol-1-one Traditional Name: 3-(1-aminoethyl)-6-butoxy-2-(2,2-diethoxyethyl)isoindolin-1-one Formula: C20H32N2O4 MolecularWeight: 364.47908

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC2=C(C=C1)C(N(C2=O)CC(OCC)OCC)C(C)N

Isomeric SMILES

CCCCOC1=CC2=C(C=C1)C(N(C2=O)CC(OCC)OCC)C(C)N

InChI

InChI=1S/C20H32N2O4/c1-5-8-11-26-15-9-10-16-17(12-15)20(23)22(19(16)14(4)21)13-18(24-6-2)25-7-3/h9-10,12,14,18-19H,5-8,11,13,21H2,1-4H3