2-azanyl-3-butoxy-2-[(3-cyanophenyl)methyl]-3-oxidanylidene-propanoic acid

Systemtic Name: 2-azanyl-3-butoxy-2-[(3-cyanophenyl)methyl]-3-oxidanylidene-propanoic acid Openeye Name: 2-amino-3-butoxy-2-[(3-cyanophenyl)methyl]-3-oxo-propanoic acid CAS Name: 2-amino-3-butoxy-2-[(3-cyanophenyl)methyl]-3-oxopropanoic acid IUPAC Name: 2-amino-3-butoxy-2-[(3-cyanophenyl)methyl]-3-oxopropanoic acid Traditional Name: 2-amino-3-butoxy-2-(3-cyanobenzyl)-3-keto-propionic acid Formula: C15H18N2O4 MolecularWeight: 290.31442

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(CC1=CC=CC(=C1)C#N)(C(=O)O)N

Isomeric SMILES

CCCCOC(=O)C(CC1=CC=CC(=C1)C#N)(C(=O)O)N

InChI

InChI=1S/C15H18N2O4/c1-2-3-7-21-14(20)15(17,13(18)19)9-11-5-4-6-12(8-11)10-16/h4-6,8H,2-3,7,9,17H2,1H3,(H,18,19)