[5-(1,3-benzodioxol-5-yl)thiophen-2-yl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone

Systemtic Name: [5-(1,3-benzodioxol-5-yl)thiophen-2-yl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone Openeye Name: [5-(1,3-benzodioxol-5-yl)-2-thienyl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone CAS Name: [5-(1,3-benzodioxol-5-yl)-2-thiophenyl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone IUPAC Name: [5-(1,3-benzodioxol-5-yl)thiophen-2-yl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone Traditional Name: [5-(1,3-benzodioxol-5-yl)-2-thienyl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone Formula: C21H17NO3S MolecularWeight: 363.42958

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)C3=CC=C(S3)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)C3=CC=C(S3)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C21H17NO3S/c23-21(22-10-9-14-3-1-2-4-16(14)12-22)20-8-7-19(26-20)15-5-6-17-18(11-15)25-13-24-17/h1-8,11H,9-10,12-13H2