methyl 2-(methoxymethyl)-4-(4-methyl-1,4-diazepan-1-yl)benzoate

Systemtic Name: methyl 2-(methoxymethyl)-4-(4-methyl-1,4-diazepan-1-yl)benzoate Openeye Name: methyl 2-(methoxymethyl)-4-(4-methyl-1,4-diazepan-1-yl)benzoate CAS Name: 2-(methoxymethyl)-4-(4-methyl-1,4-diazepan-1-yl)benzoic acid methyl ester IUPAC Name: methyl 2-(methoxymethyl)-4-(4-methyl-1,4-diazepan-1-yl)benzoate Traditional Name: 2-(methoxymethyl)-4-(4-methyl-1,4-diazepan-1-yl)benzoic acid methyl ester Formula: C16H24N2O3 MolecularWeight: 292.37336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCCN(CC1)C2=CC(=C(C=C2)C(=O)OC)COC

Isomeric SMILES

CN1CCCN(CC1)C2=CC(=C(C=C2)C(=O)OC)COC

InChI

InChI=1S/C16H24N2O3/c1-17-7-4-8-18(10-9-17)14-5-6-15(16(19)21-3)13(11-14)12-20-2/h5-6,11H,4,7-10,12H2,1-3H3