(2-methylphenyl) 3-(3,4-dihydro-2H-pyrrol-5-ylamino)cyclohexane-1-carboxylate

Systemtic Name: (2-methylphenyl) 3-(3,4-dihydro-2H-pyrrol-5-ylamino)cyclohexane-1-carboxylate Openeye Name: o-tolyl 3-(3,4-dihydro-2H-pyrrol-5-ylamino)cyclohexanecarboxylate CAS Name: 3-(3,4-dihydro-2H-pyrrol-5-ylamino)-1-cyclohexanecarboxylic acid (2-methylphenyl) ester IUPAC Name: (2-methylphenyl) 3-(3,4-dihydro-2H-pyrrol-5-ylamino)cyclohexane-1-carboxylate Traditional Name: 3-(1-pyrrolin-2-ylamino)cyclohexanecarboxylic acid o-tolyl ester Formula: C18H24N2O2 MolecularWeight: 300.39536

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OC(=O)C2CCCC(C2)NC3=NCCC3

Isomeric SMILES

CC1=CC=CC=C1OC(=O)C2CCCC(C2)NC3=NCCC3

InChI

InChI=1S/C18H24N2O2/c1-13-6-2-3-9-16(13)22-18(21)14-7-4-8-15(12-14)20-17-10-5-11-19-17/h2-3,6,9,14-15H,4-5,7-8,10-12H2,1H3,(H,19,20)