butan-1-amine; 3-(3-chlorophenyl)-2-(2-diethylaminoethyl)-3H-isoindol-1-one

Systemtic Name: butan-1-amine; 3-(3-chlorophenyl)-2-(2-diethylaminoethyl)-3H-isoindol-1-one Openeye Name: butan-1-amine; 3-(3-chlorophenyl)-2-(2-diethylaminoethyl)isoindolin-1-one CAS Name: 1-butanamine; 3-(3-chlorophenyl)-2-(2-diethylaminoethyl)-3H-isoindol-1-one IUPAC Name: butan-1-amine; 3-(3-chlorophenyl)-2-(2-diethylaminoethyl)-3H-isoindol-1-one Traditional Name: butylamine; 3-(3-chlorophenyl)-2-(2-diethylaminoethyl)isoindolin-1-one Formula: C24H34ClN3O MolecularWeight: 415.99926

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN.CCN(CC)CCN1C(C2=CC=CC=C2C1=O)C3=CC(=CC=C3)Cl

Isomeric SMILES

CCCCN.CCN(CC)CCN1C(C2=CC=CC=C2C1=O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H23ClN2O.C4H11N/c1-3-22(4-2)12-13-23-19(15-8-7-9-16(21)14-15)17-10-5-6-11-18(17)20(23)24;1-2-3-4-5/h5-11,14,19H,3-4,12-13H2,1-2H3;2-5H2,1H3