methyl 4-[(3-aminophenyl)methyl-ethyl-amino]butanoate

Systemtic Name: methyl 4-[(3-aminophenyl)methyl-ethyl-amino]butanoate Openeye Name: methyl 4-[(3-aminophenyl)methyl-ethyl-amino]butanoate CAS Name: 4-[(3-aminophenyl)methyl-ethylamino]butanoic acid methyl ester IUPAC Name: methyl 4-[(3-aminophenyl)methyl-ethylamino]butanoate Traditional Name: 4-[(3-aminobenzyl)-ethyl-amino]butyric acid methyl ester Formula: C14H22N2O2 MolecularWeight: 250.33668

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCC(=O)OC)CC1=CC(=CC=C1)N

Isomeric SMILES

CCN(CCCC(=O)OC)CC1=CC(=CC=C1)N

InChI

InChI=1S/C14H22N2O2/c1-3-16(9-5-8-14(17)18-2)11-12-6-4-7-13(15)10-12/h4,6-7,10H,3,5,8-9,11,15H2,1-2H3