methyl 2-[[4-(aminomethyl)phenyl]carbonylamino]-3-methyl-pentanoate

Systemtic Name: methyl 2-[[4-(aminomethyl)phenyl]carbonylamino]-3-methyl-pentanoate Openeye Name: methyl 2-[[4-(aminomethyl)benzoyl]amino]-3-methyl-pentanoate CAS Name: 2-[[[4-(aminomethyl)phenyl]-oxomethyl]amino]-3-methylpentanoic acid methyl ester IUPAC Name: methyl 2-[[4-(aminomethyl)benzoyl]amino]-3-methylpentanoate Traditional Name: 2-[[4-(aminomethyl)benzoyl]amino]-3-methyl-valeric acid methyl ester Formula: C15H22N2O3 MolecularWeight: 278.34678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC)NC(=O)C1=CC=C(C=C1)CN

Isomeric SMILES

CCC(C)C(C(=O)OC)NC(=O)C1=CC=C(C=C1)CN

InChI

InChI=1S/C15H22N2O3/c1-4-10(2)13(15(19)20-3)17-14(18)12-7-5-11(9-16)6-8-12/h5-8,10,13H,4,9,16H2,1-3H3,(H,17,18)