methyl 2-[(4-chlorophenyl)methylamino]-3-methyl-pentanoate

Systemtic Name: methyl 2-[(4-chlorophenyl)methylamino]-3-methyl-pentanoate Openeye Name: methyl 2-[(4-chlorophenyl)methylamino]-3-methyl-pentanoate CAS Name: 2-[(4-chlorophenyl)methylamino]-3-methylpentanoic acid methyl ester IUPAC Name: methyl 2-[(4-chlorophenyl)methylamino]-3-methylpentanoate Traditional Name: 2-[(4-chlorobenzyl)amino]-3-methyl-valeric acid methyl ester Formula: C14H20ClNO2 MolecularWeight: 269.7671

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC)NCC1=CC=C(C=C1)Cl

Isomeric SMILES

CCC(C)C(C(=O)OC)NCC1=CC=C(C=C1)Cl

InChI

InChI=1S/C14H20ClNO2/c1-4-10(2)13(14(17)18-3)16-9-11-5-7-12(15)8-6-11/h5-8,10,13,16H,4,9H2,1-3H3