4-(2-methoxyphenyl)-1,4-diazepane-1-carboxylic acid

Systemtic Name: 4-(2-methoxyphenyl)-1,4-diazepane-1-carboxylic acid Openeye Name: 4-(2-methoxyphenyl)-1,4-diazepane-1-carboxylic acid CAS Name: 4-(2-methoxyphenyl)-1,4-diazepane-1-carboxylic acid IUPAC Name: 4-(2-methoxyphenyl)-1,4-diazepane-1-carboxylic acid Traditional Name: 4-(2-methoxyphenyl)-1,4-diazepane-1-carboxylic acid Formula: C13H18N2O3 MolecularWeight: 250.29362

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCCN(CC2)C(=O)O

Isomeric SMILES

COC1=CC=CC=C1N2CCCN(CC2)C(=O)O

InChI

InChI=1S/C13H18N2O3/c1-18-12-6-3-2-5-11(12)14-7-4-8-15(10-9-14)13(16)17/h2-3,5-6H,4,7-10H2,1H3,(H,16,17)