(4-bromanyl-1H-pyrrol-2-yl)-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone

Systemtic Name: (4-bromanyl-1H-pyrrol-2-yl)-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone Openeye Name: (4-bromo-1H-pyrrol-2-yl)-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone CAS Name: (4-bromo-1H-pyrrol-2-yl)-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone IUPAC Name: (4-bromo-1H-pyrrol-2-yl)-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone Traditional Name: (4-bromo-1H-pyrrol-2-yl)-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone Formula: C18H21BrN2O3 MolecularWeight: 393.27494

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2CN(CCC2=C1)C(=O)C3=CC(=CN3)Br)OCC

Isomeric SMILES

CCOC1=C(C=C2CN(CCC2=C1)C(=O)C3=CC(=CN3)Br)OCC

InChI

InChI=1S/C18H21BrN2O3/c1-3-23-16-7-12-5-6-21(11-13(12)8-17(16)24-4-2)18(22)15-9-14(19)10-20-15/h7-10,20H,3-6,11H2,1-2H3