N-(1-adamantylmethyl)-2-chloranyl-5-[(1R)-1-oxidanyl-2-(3-oxidanylpropylamino)ethyl]benzamide

Systemtic Name: N-(1-adamantylmethyl)-2-chloranyl-5-[(1R)-1-oxidanyl-2-(3-oxidanylpropylamino)ethyl]benzamide Openeye Name: N-(1-adamantylmethyl)-2-chloro-5-[(1R)-1-hydroxy-2-(3-hydroxypropylamino)ethyl]benzamide CAS Name: N-(1-adamantylmethyl)-2-chloro-5-[(1R)-1-hydroxy-2-(3-hydroxypropylamino)ethyl]benzamide IUPAC Name: N-(1-adamantylmethyl)-2-chloro-5-[(1R)-1-hydroxy-2-(3-hydroxypropylamino)ethyl]benzamide Traditional Name: N-(1-adamantylmethyl)-2-chloro-5-[(1R)-1-hydroxy-2-(3-hydroxypropylamino)ethyl]benzamide Formula: C23H33ClN2O3 MolecularWeight: 420.97272

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CNC(=O)C4=C(C=CC(=C4)C(CNCCCO)O)Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CNC(=O)C4=C(C=CC(=C4)[C@H](CNCCCO)O)Cl

InChI

InChI=1S/C23H33ClN2O3/c24-20-3-2-18(21(28)13-25-4-1-5-27)9-19(20)22(29)26-14-23-10-15-6-16(11-23)8-17(7-15)12-23/h2-3,9,15-17,21,25,27-28H,1,4-8,10-14H2,(H,26,29)/t15?,16?,17?,21-,23?/m0/s1