N-[4-[(4-bromophenyl)amino]-4-oxidanylidene-butyl]adamantane-1-carboxamide

Systemtic Name: N-[4-[(4-bromophenyl)amino]-4-oxidanylidene-butyl]adamantane-1-carboxamide Openeye Name: N-[4-(4-bromoanilino)-4-oxo-butyl]adamantane-1-carboxamide CAS Name: N-[4-(4-bromoanilino)-4-oxobutyl]-1-adamantanecarboxamide IUPAC Name: N-[4-(4-bromoanilino)-4-oxobutyl]adamantane-1-carboxamide Traditional Name: N-[4-(4-bromoanilino)-4-keto-butyl]adamantane-1-carboxamide Formula: C21H27BrN2O2 MolecularWeight: 419.35528

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NCCCC(=O)NC4=CC=C(C=C4)Br

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NCCCC(=O)NC4=CC=C(C=C4)Br

InChI

InChI=1S/C21H27BrN2O2/c22-17-3-5-18(6-4-17)24-19(25)2-1-7-23-20(26)21-11-14-8-15(12-21)10-16(9-14)13-21/h3-6,14-16H,1-2,7-13H2,(H,23,26)(H,24,25)