N-[3-[[(1S)-1-(1-adamantyl)ethyl]amino]-3-oxidanylidene-propyl]-4-bromanyl-benzamide

Systemtic Name: N-[3-[[(1S)-1-(1-adamantyl)ethyl]amino]-3-oxidanylidene-propyl]-4-bromanyl-benzamide Openeye Name: N-[3-[[(1S)-1-(1-adamantyl)ethyl]amino]-3-oxo-propyl]-4-bromo-benzamide CAS Name: N-[3-[[(1S)-1-(1-adamantyl)ethyl]amino]-3-oxopropyl]-4-bromobenzamide IUPAC Name: N-[3-[[(1S)-1-(1-adamantyl)ethyl]amino]-3-oxopropyl]-4-bromobenzamide Traditional Name: N-[3-[[(1S)-1-(1-adamantyl)ethyl]amino]-3-keto-propyl]-4-bromo-benzamide Formula: C22H29BrN2O2 MolecularWeight: 433.38186

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Descriptors Computed from Structure

Canonical SMILES:

CC(C12CC3CC(C1)CC(C3)C2)NC(=O)CCNC(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

C[C@@H](C12CC3CC(C1)CC(C3)C2)NC(=O)CCNC(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C22H29BrN2O2/c1-14(22-11-15-8-16(12-22)10-17(9-15)13-22)25-20(26)6-7-24-21(27)18-2-4-19(23)5-3-18/h2-5,14-17H,6-13H2,1H3,(H,24,27)(H,25,26)/t14-,15?,16?,17?,22?/m0/s1