N-[(1S)-1-(1-adamantyl)-2-[(4-bromophenyl)amino]-2-oxidanylidene-ethyl]benzamide

Systemtic Name: N-[(1S)-1-(1-adamantyl)-2-[(4-bromophenyl)amino]-2-oxidanylidene-ethyl]benzamide Openeye Name: N-[(1S)-1-(1-adamantyl)-2-(4-bromoanilino)-2-oxo-ethyl]benzamide CAS Name: N-[(1S)-1-(1-adamantyl)-2-(4-bromoanilino)-2-oxoethyl]benzamide IUPAC Name: N-[(1S)-1-(1-adamantyl)-2-(4-bromoanilino)-2-oxoethyl]benzamide Traditional Name: N-[(1S)-1-(1-adamantyl)-2-(4-bromoanilino)-2-keto-ethyl]benzamide Formula: C25H27BrN2O2 MolecularWeight: 467.39808

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(C(=O)NC4=CC=C(C=C4)Br)NC(=O)C5=CC=CC=C5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)[C@@H](C(=O)NC4=CC=C(C=C4)Br)NC(=O)C5=CC=CC=C5

InChI

InChI=1S/C25H27BrN2O2/c26-20-6-8-21(9-7-20)27-24(30)22(28-23(29)19-4-2-1-3-5-19)25-13-16-10-17(14-25)12-18(11-16)15-25/h1-9,16-18,22H,10-15H2,(H,27,30)(H,28,29)/t16?,17?,18?,22-,25?/m1/s1