2-ethoxy-1-(quinoxalin-2-ylamino)cyclohexane-1-carboxylic acid

Systemtic Name: 2-ethoxy-1-(quinoxalin-2-ylamino)cyclohexane-1-carboxylic acid Openeye Name: 2-ethoxy-1-(quinoxalin-2-ylamino)cyclohexanecarboxylic acid CAS Name: 2-ethoxy-1-(2-quinoxalinylamino)-1-cyclohexanecarboxylic acid IUPAC Name: 2-ethoxy-1-(quinoxalin-2-ylamino)cyclohexane-1-carboxylic acid Traditional Name: 2-ethoxy-1-(quinoxalin-2-ylamino)cyclohexanecarboxylic acid Formula: C17H21N3O3 MolecularWeight: 315.36694

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1CCCCC1(C(=O)O)NC2=NC3=CC=CC=C3N=C2

Isomeric SMILES

CCOC1CCCCC1(C(=O)O)NC2=NC3=CC=CC=C3N=C2

InChI

InChI=1S/C17H21N3O3/c1-2-23-14-9-5-6-10-17(14,16(21)22)20-15-11-18-12-7-3-4-8-13(12)19-15/h3-4,7-8,11,14H,2,5-6,9-10H2,1H3,(H,19,20)(H,21,22)