5-(2-hydroxyethyl)-9-(hydroxymethyl)-3,4,9,9a-tetrahydro-2H-1,5-benzoxazepine-4-carboxamide

Systemtic Name: 5-(2-hydroxyethyl)-9-(hydroxymethyl)-3,4,9,9a-tetrahydro-2H-1,5-benzoxazepine-4-carboxamide Openeye Name: 5-(2-hydroxyethyl)-9-(hydroxymethyl)-3,4,9,9a-tetrahydro-2H-1,5-benzoxazepine-4-carboxamide CAS Name: 5-(2-hydroxyethyl)-9-(hydroxymethyl)-3,4,9,9a-tetrahydro-2H-1,5-benzoxazepine-4-carboxamide IUPAC Name: 5-(2-hydroxyethyl)-9-(hydroxymethyl)-3,4,9,9a-tetrahydro-2H-1,5-benzoxazepine-4-carboxamide Traditional Name: 5-(2-hydroxyethyl)-9-methylol-3,4,9,9a-tetrahydro-2H-1,5-benzoxazepine-4-carboxamide Formula: C13H20N2O4 MolecularWeight: 268.3089

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2C(C=CC=C2N(C1C(=O)N)CCO)CO

Isomeric SMILES

C1COC2C(C=CC=C2N(C1C(=O)N)CCO)CO

InChI

InChI=1S/C13H20N2O4/c14-13(18)11-4-7-19-12-9(8-17)2-1-3-10(12)15(11)5-6-16/h1-3,9,11-12,16-17H,4-8H2,(H2,14,18)