2,4-bis(oxidanylidene)-4-[3-(phenylmethyl)phenyl]butanoic acid; N-methylmethanamine

Systemtic Name: 2,4-bis(oxidanylidene)-4-[3-(phenylmethyl)phenyl]butanoic acid; N-methylmethanamine Openeye Name: 4-(3-benzylphenyl)-2,4-dioxo-butanoic acid; N-methylmethanamine CAS Name: 2,4-dioxo-4-[3-(phenylmethyl)phenyl]butanoic acid; N-methylmethanamine IUPAC Name: 4-(3-benzylphenyl)-2,4-dioxobutanoic acid; N-methylmethanamine Traditional Name: 4-(3-benzylphenyl)-2,4-diketo-butyric acid; dimethylamine Formula: C19H21NO4 MolecularWeight: 327.37434

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H14O4.C2H7N/c18-15(11-16(19)17(20)21)14-8-4-7-13(10-14)9-12-5-2-1-3-6-12;1-3-2/h1-8,10H,9,11H2,(H,20,21);3H,1-2H3