(6-bromanyl-3,4-dihydro-2H-quinolin-1-yl)-[4-(diethoxyphosphorylmethyl)phenyl]methanone

Systemtic Name: (6-bromanyl-3,4-dihydro-2H-quinolin-1-yl)-[4-(diethoxyphosphorylmethyl)phenyl]methanone Openeye Name: (6-bromo-3,4-dihydro-2H-quinolin-1-yl)-[4-(diethoxyphosphorylmethyl)phenyl]methanone CAS Name: (6-bromo-3,4-dihydro-2H-quinolin-1-yl)-[4-(diethoxyphosphorylmethyl)phenyl]methanone IUPAC Name: (6-bromo-3,4-dihydro-2H-quinolin-1-yl)-[4-(diethoxyphosphorylmethyl)phenyl]methanone Traditional Name: (6-bromo-3,4-dihydro-2H-quinolin-1-yl)-[4-(diethoxyphosphorylmethyl)phenyl]methanone Formula: C21H25BrNO4P MolecularWeight: 466.305261

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(CC1=CC=C(C=C1)C(=O)N2CCCC3=C2C=CC(=C3)Br)OCC

Isomeric SMILES

CCOP(=O)(CC1=CC=C(C=C1)C(=O)N2CCCC3=C2C=CC(=C3)Br)OCC

InChI

InChI=1S/C21H25BrNO4P/c1-3-26-28(25,27-4-2)15-16-7-9-17(10-8-16)21(24)23-13-5-6-18-14-19(22)11-12-20(18)23/h7-12,14H,3-6,13,15H2,1-2H3