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

Systemtic Name: [1-(aminomethyl)piperidin-4-yl]methyl 4-azanyl-2,3,5-trimethyl-benzoate Openeye Name: [1-(aminomethyl)-4-piperidyl]methyl 4-amino-2,3,5-trimethyl-benzoate CAS Name: 4-amino-2,3,5-trimethylbenzoic acid [1-(aminomethyl)-4-piperidinyl]methyl ester IUPAC Name: [1-(aminomethyl)piperidin-4-yl]methyl 4-amino-2,3,5-trimethylbenzoate Traditional Name: 4-amino-2,3,5-trimethyl-benzoic acid [1-(aminomethyl)-4-piperidyl]methyl ester Formula: C17H27N3O2 MolecularWeight: 305.41518

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H27N3O2/c1-11-8-15(12(2)13(3)16(11)19)17(21)22-9-14-4-6-20(10-18)7-5-14/h8,14H,4-7,9-10,18-19H2,1-3H3