2-(3-azanyl-3-methoxy-cyclohexa-1,5-dien-1-yl)sulfonylethanol

Systemtic Name: 2-(3-azanyl-3-methoxy-cyclohexa-1,5-dien-1-yl)sulfonylethanol Openeye Name: 2-(3-amino-3-methoxy-cyclohexa-1,5-dien-1-yl)sulfonylethanol CAS Name: 2-[(3-amino-3-methoxy-1-cyclohexa-1,5-dienyl)sulfonyl]ethanol IUPAC Name: 2-(3-amino-3-methoxycyclohexa-1,5-dien-1-yl)sulfonylethanol Traditional Name: 2-(3-amino-3-methoxy-cyclohexa-1,5-dien-1-yl)sulfonylethanol Formula: C9H15NO4S MolecularWeight: 233.2847

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Descriptors Computed from Structure

Canonical SMILES:

COC1(CC=CC(=C1)S(=O)(=O)CCO)N

Isomeric SMILES

COC1(CC=CC(=C1)S(=O)(=O)CCO)N

InChI

InChI=1S/C9H15NO4S/c1-14-9(10)4-2-3-8(7-9)15(12,13)6-5-11/h2-3,7,11H,4-6,10H2,1H3