N-(1-azanyl-1-oxidanylidene-propan-2-yl)-3-(4-methylphenyl)adamantane-1-carboxamide dihydrochloride

Systemtic Name: N-(1-azanyl-1-oxidanylidene-propan-2-yl)-3-(4-methylphenyl)adamantane-1-carboxamide dihydrochloride Openeye Name: N-(2-amino-1-methyl-2-oxo-ethyl)-3-(p-tolyl)adamantane-1-carboxamide dihydrochloride CAS Name: N-(1-amino-1-oxopropan-2-yl)-3-(4-methylphenyl)-1-adamantanecarboxamide dihydrochloride IUPAC Name: N-(1-amino-1-oxopropan-2-yl)-3-(4-methylphenyl)adamantane-1-carboxamide dihydrochloride Traditional Name: N-(2-amino-2-keto-1-methyl-ethyl)-3-(p-tolyl)adamantane-1-carboxamide dihydrochloride Formula: C21H30Cl2N2O2 MolecularWeight: 413.3811

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C23CC4CC(C2)CC(C4)(C3)C(=O)NC(C)C(=O)N.Cl.Cl

Isomeric SMILES

CC1=CC=C(C=C1)C23CC4CC(C2)CC(C4)(C3)C(=O)NC(C)C(=O)N.Cl.Cl

InChI

InChI=1S/C21H28N2O2.2ClH/c1-13-3-5-17(6-4-13)20-8-15-7-16(9-20)11-21(10-15,12-20)19(25)23-14(2)18(22)24;;/h3-6,14-16H,7-12H2,1-2H3,(H2,22,24)(H,23,25);2*1H