N-(1-adamantylmethyl)-2-chloranyl-5-[(2S)-3-(ethylamino)-2-oxidanyl-propyl]benzamide

Systemtic Name: N-(1-adamantylmethyl)-2-chloranyl-5-[(2S)-3-(ethylamino)-2-oxidanyl-propyl]benzamide Openeye Name: N-(1-adamantylmethyl)-2-chloro-5-[(2S)-3-(ethylamino)-2-hydroxy-propyl]benzamide CAS Name: N-(1-adamantylmethyl)-2-chloro-5-[(2S)-3-(ethylamino)-2-hydroxypropyl]benzamide IUPAC Name: N-(1-adamantylmethyl)-2-chloro-5-[(2S)-3-(ethylamino)-2-hydroxypropyl]benzamide Traditional Name: N-(1-adamantylmethyl)-2-chloro-5-[(2S)-3-(ethylamino)-2-hydroxy-propyl]benzamide Formula: C23H33ClN2O2 MolecularWeight: 404.97332

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNCC(CC1=CC(=C(C=C1)Cl)C(=O)NCC23CC4CC(C2)CC(C4)C3)O

Isomeric SMILES

CCNC[C@H](CC1=CC(=C(C=C1)Cl)C(=O)NCC23CC4CC(C2)CC(C4)C3)O

InChI

InChI=1S/C23H33ClN2O2/c1-2-25-13-19(27)8-15-3-4-21(24)20(9-15)22(28)26-14-23-10-16-5-17(11-23)7-18(6-16)12-23/h3-4,9,16-19,25,27H,2,5-8,10-14H2,1H3,(H,26,28)/t16?,17?,18?,19-,23?/m0/s1