4-[(3-methylphenyl)methylamino]bicyclo[3.1.0]hexane-4,6-dicarboxylic acid

Systemtic Name: 4-[(3-methylphenyl)methylamino]bicyclo[3.1.0]hexane-4,6-dicarboxylic acid Openeye Name: 4-(m-tolylmethylamino)bicyclo[3.1.0]hexane-4,6-dicarboxylic acid CAS Name: 4-[(3-methylphenyl)methylamino]bicyclo[3.1.0]hexane-4,6-dicarboxylic acid IUPAC Name: 4-[(3-methylphenyl)methylamino]bicyclo[3.1.0]hexane-4,6-dicarboxylic acid Traditional Name: 4-[(3-methylbenzyl)amino]bicyclo[3.1.0]hexane-4,6-dicarboxylic acid Formula: C16H19NO4 MolecularWeight: 289.32636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CNC2(CCC3C2C3C(=O)O)C(=O)O

Isomeric SMILES

CC1=CC(=CC=C1)CNC2(CCC3C2C3C(=O)O)C(=O)O

InChI

InChI=1S/C16H19NO4/c1-9-3-2-4-10(7-9)8-17-16(15(20)21)6-5-11-12(13(11)16)14(18)19/h2-4,7,11-13,17H,5-6,8H2,1H3,(H,18,19)(H,20,21)