2-butyl-4-methyl-3-propyl-3H-isoindol-1-one

Systemtic Name: 2-butyl-4-methyl-3-propyl-3H-isoindol-1-one Openeye Name: 2-butyl-4-methyl-3-propyl-isoindolin-1-one CAS Name: 2-butyl-4-methyl-3-propyl-3H-isoindol-1-one IUPAC Name: 2-butyl-4-methyl-3-propyl-3H-isoindol-1-one Traditional Name: 2-butyl-4-methyl-3-propyl-isoindolin-1-one Formula: C16H23NO MolecularWeight: 245.35992

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(C2=C(C1=O)C=CC=C2C)CCC

Isomeric SMILES

CCCCN1C(C2=C(C1=O)C=CC=C2C)CCC

InChI

InChI=1S/C16H23NO/c1-4-6-11-17-14(8-5-2)15-12(3)9-7-10-13(15)16(17)18/h7,9-10,14H,4-6,8,11H2,1-3H3