methyl 4-azanyl-3-[[(4-oxidanylcyclohexyl)amino]methyl]benzoate

Systemtic Name: methyl 4-azanyl-3-[[(4-oxidanylcyclohexyl)amino]methyl]benzoate Openeye Name: methyl 4-amino-3-[[(4-hydroxycyclohexyl)amino]methyl]benzoate CAS Name: 4-amino-3-[[(4-hydroxycyclohexyl)amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-amino-3-[[(4-hydroxycyclohexyl)amino]methyl]benzoate Traditional Name: 4-amino-3-[[(4-hydroxycyclohexyl)amino]methyl]benzoic acid methyl ester Formula: C15H22N2O3 MolecularWeight: 278.34678

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)N)CNC2CCC(CC2)O

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)N)CNC2CCC(CC2)O

InChI

InChI=1S/C15H22N2O3/c1-20-15(19)10-2-7-14(16)11(8-10)9-17-12-3-5-13(18)6-4-12/h2,7-8,12-13,17-18H,3-6,9,16H2,1H3