methyl 3-azanyl-2-[(3-cyanophenyl)methyl]pentanoate

Systemtic Name: methyl 3-azanyl-2-[(3-cyanophenyl)methyl]pentanoate Openeye Name: methyl 3-amino-2-[(3-cyanophenyl)methyl]pentanoate CAS Name: 3-amino-2-[(3-cyanophenyl)methyl]pentanoic acid methyl ester IUPAC Name: methyl 3-amino-2-[(3-cyanophenyl)methyl]pentanoate Traditional Name: 3-amino-2-(3-cyanobenzyl)valeric acid methyl ester Formula: C14H18N2O2 MolecularWeight: 246.30492

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(CC1=CC=CC(=C1)C#N)C(=O)OC)N

Isomeric SMILES

CCC(C(CC1=CC=CC(=C1)C#N)C(=O)OC)N

InChI

InChI=1S/C14H18N2O2/c1-3-13(16)12(14(17)18-2)8-10-5-4-6-11(7-10)9-15/h4-7,12-13H,3,8,16H2,1-2H3