N-(2-acetamidoethyl)-4-(4-methylphenyl)-1-oxidanylidene-isochromene-3-carboxamide

Systemtic Name: N-(2-acetamidoethyl)-4-(4-methylphenyl)-1-oxidanylidene-isochromene-3-carboxamide Openeye Name: N-(2-acetamidoethyl)-1-oxo-4-(p-tolyl)isochromene-3-carboxamide CAS Name: N-(2-acetamidoethyl)-4-(4-methylphenyl)-1-oxo-2-benzopyran-3-carboxamide IUPAC Name: N-(2-acetamidoethyl)-4-(4-methylphenyl)-1-oxoisochromene-3-carboxamide Traditional Name: N-(2-acetamidoethyl)-1-keto-4-(p-tolyl)isochromene-3-carboxamide Formula: C21H20N2O4 MolecularWeight: 364.3945

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(OC(=O)C3=CC=CC=C32)C(=O)NCCNC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(OC(=O)C3=CC=CC=C32)C(=O)NCCNC(=O)C

InChI

InChI=1S/C21H20N2O4/c1-13-7-9-15(10-8-13)18-16-5-3-4-6-17(16)21(26)27-19(18)20(25)23-12-11-22-14(2)24/h3-10H,11-12H2,1-2H3,(H,22,24)(H,23,25)