4-[2-ethoxy-5-(phenylmethyl)phenyl]-2,4-bis(oxidanylidene)butanoic acid; N-methylmethanamine

Systemtic Name: 4-[2-ethoxy-5-(phenylmethyl)phenyl]-2,4-bis(oxidanylidene)butanoic acid; N-methylmethanamine Openeye Name: 4-(5-benzyl-2-ethoxy-phenyl)-2,4-dioxo-butanoic acid; N-methylmethanamine CAS Name: 4-[2-ethoxy-5-(phenylmethyl)phenyl]-2,4-dioxobutanoic acid; N-methylmethanamine IUPAC Name: 4-(5-benzyl-2-ethoxyphenyl)-2,4-dioxobutanoic acid; N-methylmethanamine Traditional Name: 4-(5-benzyl-2-ethoxy-phenyl)-2,4-diketo-butyric acid; dimethylamine Formula: C21H25NO5 MolecularWeight: 371.4269

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CC2=CC=CC=C2)C(=O)CC(=O)C(=O)O.CNC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CC2=CC=CC=C2)C(=O)CC(=O)C(=O)O.CNC

InChI

InChI=1S/C19H18O5.C2H7N/c1-2-24-18-9-8-14(10-13-6-4-3-5-7-13)11-15(18)16(20)12-17(21)19(22)23;1-3-2/h3-9,11H,2,10,12H2,1H3,(H,22,23);3H,1-2H3