4-azanyl-2-[2-[ethyl(2-methylpropanoyl)amino]propanoyl]benzoate

Systemtic Name: 4-azanyl-2-[2-[ethyl(2-methylpropanoyl)amino]propanoyl]benzoate Openeye Name: 4-amino-2-[2-[ethyl(2-methylpropanoyl)amino]propanoyl]benzoate CAS Name: 4-amino-2-[2-[ethyl-(2-methyl-1-oxopropyl)amino]-1-oxopropyl]benzoate IUPAC Name: 4-amino-2-[2-[ethyl(2-methylpropanoyl)amino]propanoyl]benzoate Traditional Name: 4-amino-2-[2-[ethyl(isobutyryl)amino]propanoyl]benzoate Formula: C16H21N2O4- MolecularWeight: 305.34894

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C(C)C(=O)C1=C(C=CC(=C1)N)C(=O)[O-])C(=O)C(C)C

Isomeric SMILES

CCN(C(C)C(=O)C1=C(C=CC(=C1)N)C(=O)[O-])C(=O)C(C)C

InChI

InChI=1S/C16H22N2O4/c1-5-18(15(20)9(2)3)10(4)14(19)13-8-11(17)6-7-12(13)16(21)22/h6-10H,5,17H2,1-4H3,(H,21,22)/p-1