6-azanyl-4-(3-chloranylpropoxy)-4-methoxy-cyclohexa-1,5-diene-1-carboxylic acid

Systemtic Name: 6-azanyl-4-(3-chloranylpropoxy)-4-methoxy-cyclohexa-1,5-diene-1-carboxylic acid Openeye Name: 6-amino-4-(3-chloropropoxy)-4-methoxy-cyclohexa-1,5-diene-1-carboxylic acid CAS Name: 6-amino-4-(3-chloropropoxy)-4-methoxy-1-cyclohexa-1,5-dienecarboxylic acid IUPAC Name: 6-amino-4-(3-chloropropoxy)-4-methoxycyclohexa-1,5-diene-1-carboxylic acid Traditional Name: 6-amino-4-(3-chloropropoxy)-4-methoxy-cyclohexa-1,5-diene-1-carboxylic acid Formula: C11H16ClNO4 MolecularWeight: 261.70204

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1(CC=C(C(=C1)N)C(=O)O)OCCCCl

Isomeric SMILES

COC1(CC=C(C(=C1)N)C(=O)O)OCCCCl

InChI

InChI=1S/C11H16ClNO4/c1-16-11(17-6-2-5-12)4-3-8(10(14)15)9(13)7-11/h3,7H,2,4-6,13H2,1H3,(H,14,15)