N-butyl-9-[[2-(4-hydroxyphenyl)carbonyl-6-oxidanyl-3,4-dihydro-1H-isoquinolin-3-yl]methoxy]-N-methyl-nonanamide

Systemtic Name: N-butyl-9-[[2-(4-hydroxyphenyl)carbonyl-6-oxidanyl-3,4-dihydro-1H-isoquinolin-3-yl]methoxy]-N-methyl-nonanamide Openeye Name: N-butyl-9-[[6-hydroxy-2-(4-hydroxybenzoyl)-3,4-dihydro-1H-isoquinolin-3-yl]methoxy]-N-methyl-nonanamide CAS Name: N-butyl-9-[[6-hydroxy-2-[(4-hydroxyphenyl)-oxomethyl]-3,4-dihydro-1H-isoquinolin-3-yl]methoxy]-N-methylnonanamide IUPAC Name: N-butyl-9-[[6-hydroxy-2-(4-hydroxybenzoyl)-3,4-dihydro-1H-isoquinolin-3-yl]methoxy]-N-methylnonanamide Traditional Name: N-butyl-9-[[6-hydroxy-2-(4-hydroxybenzoyl)-3,4-dihydro-1H-isoquinolin-3-yl]methoxy]-N-methyl-pelargonamide Formula: C31H44N2O5 MolecularWeight: 524.69146

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C(=O)CCCCCCCCOCC1CC2=C(CN1C(=O)C3=CC=C(C=C3)O)C=CC(=C2)O

Isomeric SMILES

CCCCN(C)C(=O)CCCCCCCCOCC1CC2=C(CN1C(=O)C3=CC=C(C=C3)O)C=CC(=C2)O

InChI

InChI=1S/C31H44N2O5/c1-3-4-18-32(2)30(36)11-9-7-5-6-8-10-19-38-23-27-20-26-21-29(35)17-14-25(26)22-33(27)31(37)24-12-15-28(34)16-13-24/h12-17,21,27,34-35H,3-11,18-20,22-23H2,1-2H3