3-[5-methyl-4-[(Z)-C-methyl-N-[(3-oxidanylnaphthalen-2-yl)carbonylamino]carbonimidoyl]furan-2-yl]propanoic acid

Systemtic Name: 3-[5-methyl-4-[(Z)-C-methyl-N-[(3-oxidanylnaphthalen-2-yl)carbonylamino]carbonimidoyl]furan-2-yl]propanoic acid Openeye Name: 3-[4-[(Z)-N-[(3-hydroxynaphthalene-2-carbonyl)amino]-C-methyl-carbonimidoyl]-5-methyl-2-furyl]propanoic acid CAS Name: 3-[4-[(1Z)-1-[[(3-hydroxy-2-naphthalenyl)-oxomethyl]hydrazinylidene]ethyl]-5-methyl-2-furanyl]propanoic acid IUPAC Name: 3-[4-[(Z)-N-[(3-hydroxynaphthalene-2-carbonyl)amino]-C-methylcarbonimidoyl]-5-methylfuran-2-yl]propanoic acid Traditional Name: 3-[4-[(Z)-N-[(3-hydroxy-2-naphthoyl)amino]-C-methyl-carbonimidoyl]-5-methyl-2-furyl]propionic acid Formula: C21H20N2O5 MolecularWeight: 380.3939

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)CCC(=O)O)C(=NNC(=O)C2=CC3=CC=CC=C3C=C2O)C

Isomeric SMILES

CC1=C(C=C(O1)CCC(=O)O)/C(=N\NC(=O)C2=CC3=CC=CC=C3C=C2O)/C

InChI

InChI=1S/C21H20N2O5/c1-12(17-11-16(28-13(17)2)7-8-20(25)26)22-23-21(27)18-9-14-5-3-4-6-15(14)10-19(18)24/h3-6,9-11,24H,7-8H2,1-2H3,(H,23,27)(H,25,26)/b22-12-