N-(1-adamantylmethyl)-2-chloranyl-5-[3-(4-oxidanylbutylamino)propyl]benzamide

Systemtic Name: N-(1-adamantylmethyl)-2-chloranyl-5-[3-(4-oxidanylbutylamino)propyl]benzamide Openeye Name: N-(1-adamantylmethyl)-2-chloro-5-[3-(4-hydroxybutylamino)propyl]benzamide CAS Name: N-(1-adamantylmethyl)-2-chloro-5-[3-(4-hydroxybutylamino)propyl]benzamide IUPAC Name: N-(1-adamantylmethyl)-2-chloro-5-[3-(4-hydroxybutylamino)propyl]benzamide Traditional Name: N-(1-adamantylmethyl)-2-chloro-5-[3-(4-hydroxybutylamino)propyl]benzamide Formula: C25H37ClN2O2 MolecularWeight: 433.02648

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H37ClN2O2/c26-23-6-5-18(4-3-8-27-7-1-2-9-29)13-22(23)24(30)28-17-25-14-19-10-20(15-25)12-21(11-19)16-25/h5-6,13,19-21,27,29H,1-4,7-12,14-17H2,(H,28,30)