2-methoxy-4-[naphthalen-2-ylmethyl-(3-oxidanylidene-3-pyrimidin-2-yl-propanoyl)amino]benzoic acid

Systemtic Name: 2-methoxy-4-[naphthalen-2-ylmethyl-(3-oxidanylidene-3-pyrimidin-2-yl-propanoyl)amino]benzoic acid Openeye Name: 2-methoxy-4-[2-naphthylmethyl-(3-oxo-3-pyrimidin-2-yl-propanoyl)amino]benzoic acid CAS Name: 4-[[1,3-dioxo-3-(2-pyrimidinyl)propyl]-(2-naphthalenylmethyl)amino]-2-methoxybenzoic acid IUPAC Name: 2-methoxy-4-[naphthalen-2-ylmethyl-(3-oxo-3-pyrimidin-2-ylpropanoyl)amino]benzoic acid Traditional Name: 4-[[3-keto-3-(2-pyrimidyl)propanoyl]-(2-naphthylmethyl)amino]-2-methoxy-benzoic acid Formula: C26H21N3O5 MolecularWeight: 455.46204

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)N(CC2=CC3=CC=CC=C3C=C2)C(=O)CC(=O)C4=NC=CC=N4)C(=O)O

Isomeric SMILES

COC1=C(C=CC(=C1)N(CC2=CC3=CC=CC=C3C=C2)C(=O)CC(=O)C4=NC=CC=N4)C(=O)O

InChI

InChI=1S/C26H21N3O5/c1-34-23-14-20(9-10-21(23)26(32)33)29(24(31)15-22(30)25-27-11-4-12-28-25)16-17-7-8-18-5-2-3-6-19(18)13-17/h2-14H,15-16H2,1H3,(H,32,33)