methyl 2-[[cyclohexyl-[(1-methylpyrrol-2-yl)methyl]amino]methyl]benzoate

Systemtic Name: methyl 2-[[cyclohexyl-[(1-methylpyrrol-2-yl)methyl]amino]methyl]benzoate Openeye Name: methyl 2-[[cyclohexyl-[(1-methylpyrrol-2-yl)methyl]amino]methyl]benzoate CAS Name: 2-[[cyclohexyl-[(1-methyl-2-pyrrolyl)methyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 2-[[cyclohexyl-[(1-methylpyrrol-2-yl)methyl]amino]methyl]benzoate Traditional Name: 2-[[cyclohexyl-[(1-methylpyrrol-2-yl)methyl]amino]methyl]benzoic acid methyl ester Formula: C21H28N2O2 MolecularWeight: 340.45922

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1CN(CC2=CC=CC=C2C(=O)OC)C3CCCCC3

Isomeric SMILES

CN1C=CC=C1CN(CC2=CC=CC=C2C(=O)OC)C3CCCCC3

InChI

InChI=1S/C21H28N2O2/c1-22-14-8-12-19(22)16-23(18-10-4-3-5-11-18)15-17-9-6-7-13-20(17)21(24)25-2/h6-9,12-14,18H,3-5,10-11,15-16H2,1-2H3