N-ethyl-2-[[1-(3-methylphenyl)-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]butanamide

Systemtic Name: N-ethyl-2-[[1-(3-methylphenyl)-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]butanamide Openeye Name: N-ethyl-2-[[1-(m-tolyl)-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]butanamide CAS Name: N-ethyl-2-[[1-(3-methylphenyl)-2-(1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]butanamide IUPAC Name: N-ethyl-2-[[1-(3-methylphenyl)-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]butanamide Traditional Name: N-ethyl-2-[[1-(m-tolyl)-2-propionyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]butyramide Formula: C25H32N2O3 MolecularWeight: 408.53318

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NCC)OC1=CC2=C(CCN(C2C3=CC(=CC=C3)C)C(=O)CC)C=C1

Isomeric SMILES

CCC(C(=O)NCC)OC1=CC2=C(CCN(C2C3=CC(=CC=C3)C)C(=O)CC)C=C1

InChI

InChI=1S/C25H32N2O3/c1-5-22(25(29)26-7-3)30-20-12-11-18-13-14-27(23(28)6-2)24(21(18)16-20)19-10-8-9-17(4)15-19/h8-12,15-16,22,24H,5-7,13-14H2,1-4H3,(H,26,29)