1-methyl-4-propan-2-yl-benzene; 3,6,6-trimethyl-4-oxidanylidene-5,7-dihydro-1-benzofuran-2-carboxamide

Systemtic Name: 1-methyl-4-propan-2-yl-benzene; 3,6,6-trimethyl-4-oxidanylidene-5,7-dihydro-1-benzofuran-2-carboxamide Openeye Name: 1-isopropyl-4-methyl-benzene; 3,6,6-trimethyl-4-oxo-5,7-dihydrobenzofuran-2-carboxamide CAS Name: 1-methyl-4-propan-2-ylbenzene; 3,6,6-trimethyl-4-oxo-5,7-dihydrobenzofuran-2-carboxamide IUPAC Name: 1-methyl-4-propan-2-ylbenzene; 3,6,6-trimethyl-4-oxo-5,7-dihydro-1-benzofuran-2-carboxamide Traditional Name: 4-keto-3,6,6-trimethyl-5,7-dihydrobenzofuran-2-carboxamide; p-cymene Formula: C22H29NO3 MolecularWeight: 355.47056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C)C.CC1=C(OC2=C1C(=O)CC(C2)(C)C)C(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)C(C)C.CC1=C(OC2=C1C(=O)CC(C2)(C)C)C(=O)N

InChI

InChI=1S/C12H15NO3.C10H14/c1-6-9-7(14)4-12(2,3)5-8(9)16-10(6)11(13)15;1-8(2)10-6-4-9(3)5-7-10/h4-5H2,1-3H3,(H2,13,15);4-8H,1-3H3