[1-(methylaminomethyl)piperidin-4-yl]methyl 4-azanyl-2,3,5-trimethyl-benzoate

Systemtic Name: [1-(methylaminomethyl)piperidin-4-yl]methyl 4-azanyl-2,3,5-trimethyl-benzoate Openeye Name: [1-(methylaminomethyl)-4-piperidyl]methyl 4-amino-2,3,5-trimethyl-benzoate CAS Name: 4-amino-2,3,5-trimethylbenzoic acid [1-(methylaminomethyl)-4-piperidinyl]methyl ester IUPAC Name: [1-(methylaminomethyl)piperidin-4-yl]methyl 4-amino-2,3,5-trimethylbenzoate Traditional Name: 4-amino-2,3,5-trimethyl-benzoic acid [1-(methylaminomethyl)-4-piperidyl]methyl ester Formula: C18H29N3O2 MolecularWeight: 319.44176

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1)C(=O)OCC2CCN(CC2)CNC)C)C)N

Isomeric SMILES

CC1=C(C(=C(C(=C1)C(=O)OCC2CCN(CC2)CNC)C)C)N

InChI

InChI=1S/C18H29N3O2/c1-12-9-16(13(2)14(3)17(12)19)18(22)23-10-15-5-7-21(8-6-15)11-20-4/h9,15,20H,5-8,10-11,19H2,1-4H3