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

Systemtic Name: methyl 2-[(3-cyanophenyl)methylamino]-3-methyl-pentanoate Openeye Name: methyl 2-[(3-cyanophenyl)methylamino]-3-methyl-pentanoate CAS Name: 2-[(3-cyanophenyl)methylamino]-3-methylpentanoic acid methyl ester IUPAC Name: methyl 2-[(3-cyanophenyl)methylamino]-3-methylpentanoate Traditional Name: 2-[(3-cyanobenzyl)amino]-3-methyl-valeric acid methyl ester Formula: C15H20N2O2 MolecularWeight: 260.3315

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC)NCC1=CC=CC(=C1)C#N

Isomeric SMILES

CCC(C)C(C(=O)OC)NCC1=CC=CC(=C1)C#N

InChI

InChI=1S/C15H20N2O2/c1-4-11(2)14(15(18)19-3)17-10-13-7-5-6-12(8-13)9-16/h5-8,11,14,17H,4,10H2,1-3H3