2-[[1-(3-fluorophenyl)-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-methyl-N-(phenylmethyl)butanamide

Systemtic Name: 2-[[1-(3-fluorophenyl)-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-methyl-N-(phenylmethyl)butanamide Openeye Name: N-benzyl-2-[[1-(3-fluorophenyl)-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-methyl-butanamide CAS Name: 2-[[1-(3-fluorophenyl)-2-(1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-methyl-N-(phenylmethyl)butanamide IUPAC Name: N-benzyl-2-[[1-(3-fluorophenyl)-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-methylbutanamide Traditional Name: N-benzyl-2-[[1-(3-fluorophenyl)-2-propionyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-methyl-butyramide Formula: C30H33FN2O3 MolecularWeight: 488.593023

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N(C)CC1=CC=CC=C1)OC2=CC3=C(CCN(C3C4=CC(=CC=C4)F)C(=O)CC)C=C2

Isomeric SMILES

CCC(C(=O)N(C)CC1=CC=CC=C1)OC2=CC3=C(CCN(C3C4=CC(=CC=C4)F)C(=O)CC)C=C2

InChI

InChI=1S/C30H33FN2O3/c1-4-27(30(35)32(3)20-21-10-7-6-8-11-21)36-25-15-14-22-16-17-33(28(34)5-2)29(26(22)19-25)23-12-9-13-24(31)18-23/h6-15,18-19,27,29H,4-5,16-17,20H2,1-3H3