methyl 4-azanyl-3-(1-azanylethyl)-5-(1-hydroxyethyl)-2-methyl-benzoate

Systemtic Name: methyl 4-azanyl-3-(1-azanylethyl)-5-(1-hydroxyethyl)-2-methyl-benzoate Openeye Name: methyl 4-amino-3-(1-aminoethyl)-5-(1-hydroxyethyl)-2-methyl-benzoate CAS Name: 4-amino-3-(1-aminoethyl)-5-(1-hydroxyethyl)-2-methylbenzoic acid methyl ester IUPAC Name: methyl 4-amino-3-(1-aminoethyl)-5-(1-hydroxyethyl)-2-methylbenzoate Traditional Name: 4-amino-3-(1-aminoethyl)-5-(1-hydroxyethyl)-2-methyl-benzoic acid methyl ester Formula: C13H20N2O3 MolecularWeight: 252.3095

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1C(=O)OC)C(C)O)N)C(C)N

Isomeric SMILES

CC1=C(C(=C(C=C1C(=O)OC)C(C)O)N)C(C)N

InChI

InChI=1S/C13H20N2O3/c1-6-9(13(17)18-4)5-10(8(3)16)12(15)11(6)7(2)14/h5,7-8,16H,14-15H2,1-4H3