N-[3-[2-(4-bromophenyl)propan-2-ylamino]-3-oxidanylidene-propyl]adamantane-1-carboxamide

Systemtic Name: N-[3-[2-(4-bromophenyl)propan-2-ylamino]-3-oxidanylidene-propyl]adamantane-1-carboxamide Openeye Name: N-[3-[[1-(4-bromophenyl)-1-methyl-ethyl]amino]-3-oxo-propyl]adamantane-1-carboxamide CAS Name: N-[3-[2-(4-bromophenyl)propan-2-ylamino]-3-oxopropyl]-1-adamantanecarboxamide IUPAC Name: N-[3-[2-(4-bromophenyl)propan-2-ylamino]-3-oxopropyl]adamantane-1-carboxamide Traditional Name: N-[3-[[1-(4-bromophenyl)-1-methyl-ethyl]amino]-3-keto-propyl]adamantane-1-carboxamide Formula: C23H31BrN2O2 MolecularWeight: 447.40844

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=C(C=C1)Br)NC(=O)CCNC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC(C)(C1=CC=C(C=C1)Br)NC(=O)CCNC(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C23H31BrN2O2/c1-22(2,18-3-5-19(24)6-4-18)26-20(27)7-8-25-21(28)23-12-15-9-16(13-23)11-17(10-15)14-23/h3-6,15-17H,7-14H2,1-2H3,(H,25,28)(H,26,27)