N-[(1S)-1-(1-adamantyl)-2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]cyclohexanecarboxamide

Systemtic Name: N-[(1S)-1-(1-adamantyl)-2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]cyclohexanecarboxamide Openeye Name: N-[(1S)-1-(1-adamantyl)-2-(4-methylanilino)-2-oxo-ethyl]cyclohexanecarboxamide CAS Name: N-[(1S)-1-(1-adamantyl)-2-(4-methylanilino)-2-oxoethyl]cyclohexanecarboxamide IUPAC Name: N-[(1S)-1-(1-adamantyl)-2-(4-methylanilino)-2-oxoethyl]cyclohexanecarboxamide Traditional Name: N-[(1S)-1-(1-adamantyl)-2-keto-2-(p-toluidino)ethyl]cyclohexanecarboxamide Formula: C26H36N2O2 MolecularWeight: 408.57624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C(C23CC4CC(C2)CC(C4)C3)NC(=O)C5CCCCC5

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)[C@H](C23CC4CC(C2)CC(C4)C3)NC(=O)C5CCCCC5

InChI

InChI=1S/C26H36N2O2/c1-17-7-9-22(10-8-17)27-25(30)23(28-24(29)21-5-3-2-4-6-21)26-14-18-11-19(15-26)13-20(12-18)16-26/h7-10,18-21,23H,2-6,11-16H2,1H3,(H,27,30)(H,28,29)/t18?,19?,20?,23-,26?/m1/s1