2-[[2-ethoxy-5-(1-hydroxyethyl)phenyl]methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: 2-[[2-ethoxy-5-(1-hydroxyethyl)phenyl]methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: 2-[[2-ethoxy-5-(1-hydroxyethyl)phenyl]methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: 2-[[2-ethoxy-5-(1-hydroxyethyl)phenyl]methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: 2-[[2-ethoxy-5-(1-hydroxyethyl)phenyl]methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: 2-[2-ethoxy-5-(1-hydroxyethyl)benzyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C21H26N2O3 MolecularWeight: 354.44274

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(C)O)CN2CC3=CC=CC=C3CC2C(=O)N

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(C)O)CN2CC3=CC=CC=C3CC2C(=O)N

InChI

InChI=1S/C21H26N2O3/c1-3-26-20-9-8-15(14(2)24)10-18(20)13-23-12-17-7-5-4-6-16(17)11-19(23)21(22)25/h4-10,14,19,24H,3,11-13H2,1-2H3,(H2,22,25)