2-butyl-4-[(E)-2-phenylethenyl]-1,4-dihydroisoquinolin-3-one

Systemtic Name: 2-butyl-4-[(E)-2-phenylethenyl]-1,4-dihydroisoquinolin-3-one Openeye Name: 2-butyl-4-[(E)-styryl]-1,4-dihydroisoquinolin-3-one CAS Name: 2-butyl-4-[(E)-2-phenylethenyl]-1,4-dihydroisoquinolin-3-one IUPAC Name: 2-butyl-4-[(E)-2-phenylethenyl]-1,4-dihydroisoquinolin-3-one Traditional Name: 2-butyl-4-[(E)-styryl]-1,4-dihydroisoquinolin-3-one Formula: C21H23NO MolecularWeight: 305.41342

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CC2=CC=CC=C2C(C1=O)C=CC3=CC=CC=C3

Isomeric SMILES

CCCCN1CC2=CC=CC=C2C(C1=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C21H23NO/c1-2-3-15-22-16-18-11-7-8-12-19(18)20(21(22)23)14-13-17-9-5-4-6-10-17/h4-14,20H,2-3,15-16H2,1H3/b14-13+