(3R)-2-[ethoxy(phenethyl)phosphoryl]-N-oxidanyl-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: (3R)-2-[ethoxy(phenethyl)phosphoryl]-N-oxidanyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: (3R)-2-[ethoxy(phenethyl)phosphoryl]-3,4-dihydro-1H-isoquinoline-3-carbohydroxamic acid CAS Name: (3R)-2-[ethoxy(phenethyl)phosphoryl]-N-hydroxy-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: (3R)-2-[ethoxy(phenethyl)phosphoryl]-N-hydroxy-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: (3R)-2-[ethoxy(phenethyl)phosphoryl]-3,4-dihydro-1H-isoquinoline-3-carbohydroxamic acid Formula: C20H25N2O4P MolecularWeight: 388.397261

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(CCC1=CC=CC=C1)N2CC3=CC=CC=C3CC2C(=O)NO

Isomeric SMILES

CCOP(=O)(CCC1=CC=CC=C1)N2CC3=CC=CC=C3C[C@@H]2C(=O)NO

InChI

InChI=1S/C20H25N2O4P/c1-2-26-27(25,13-12-16-8-4-3-5-9-16)22-15-18-11-7-6-10-17(18)14-19(22)20(23)21-24/h3-11,19,24H,2,12-15H2,1H3,(H,21,23)/t19-,27?/m1/s1