2-methylaniline; N-[1-(2-oxidanylideneheptanoylcarbamoyl)cyclohexyl]morpholine-4-carboxamide

Systemtic Name: 2-methylaniline; N-[1-(2-oxidanylideneheptanoylcarbamoyl)cyclohexyl]morpholine-4-carboxamide Openeye Name: 2-methylaniline; N-[1-(2-oxoheptanoylcarbamoyl)cyclohexyl]morpholine-4-carboxamide CAS Name: N-[1-[(1,2-dioxoheptylamino)-oxomethyl]cyclohexyl]-4-morpholinecarboxamide; 2-methylaniline IUPAC Name: 2-methylaniline; N-[1-(2-oxoheptanoylcarbamoyl)cyclohexyl]morpholine-4-carboxamide Traditional Name: N-[1-(2-ketoheptanoylcarbamoyl)cyclohexyl]morpholine-4-carboxamide; o-toluidine Formula: C26H40N4O5 MolecularWeight: 488.6196

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)C(=O)NC(=O)C1(CCCCC1)NC(=O)N2CCOCC2.CC1=CC=CC=C1N

Isomeric SMILES

CCCCCC(=O)C(=O)NC(=O)C1(CCCCC1)NC(=O)N2CCOCC2.CC1=CC=CC=C1N

InChI

InChI=1S/C19H31N3O5.C7H9N/c1-2-3-5-8-15(23)16(24)20-17(25)19(9-6-4-7-10-19)21-18(26)22-11-13-27-14-12-22;1-6-4-2-3-5-7(6)8/h2-14H2,1H3,(H,21,26)(H,20,24,25);2-5H,8H2,1H3