methyl 4-[(3S)-3-azanylbutyl]benzoate

Systemtic Name: methyl 4-[(3S)-3-azanylbutyl]benzoate Openeye Name: methyl 4-[(3S)-3-aminobutyl]benzoate CAS Name: 4-[(3S)-3-aminobutyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(3S)-3-aminobutyl]benzoate Traditional Name: 4-[(3S)-3-aminobutyl]benzoic acid methyl ester Formula: C12H17NO2 MolecularWeight: 207.26888

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=C(C=C1)C(=O)OC)N

Isomeric SMILES

C[C@@H](CCC1=CC=C(C=C1)C(=O)OC)N

InChI

InChI=1S/C12H17NO2/c1-9(13)3-4-10-5-7-11(8-6-10)12(14)15-2/h5-9H,3-4,13H2,1-2H3/t9-/m0/s1