N-(1-adamantylmethyl)-2-chloranyl-5-[(3S)-3-oxidanyl-4-(propan-2-ylamino)butyl]benzamide

Systemtic Name: N-(1-adamantylmethyl)-2-chloranyl-5-[(3S)-3-oxidanyl-4-(propan-2-ylamino)butyl]benzamide Openeye Name: N-(1-adamantylmethyl)-2-chloro-5-[(3S)-3-hydroxy-4-(isopropylamino)butyl]benzamide CAS Name: N-(1-adamantylmethyl)-2-chloro-5-[(3S)-3-hydroxy-4-(propan-2-ylamino)butyl]benzamide IUPAC Name: N-(1-adamantylmethyl)-2-chloro-5-[(3S)-3-hydroxy-4-(propan-2-ylamino)butyl]benzamide Traditional Name: N-(1-adamantylmethyl)-2-chloro-5-[(3S)-3-hydroxy-4-(isopropylamino)butyl]benzamide Formula: C25H37ClN2O2 MolecularWeight: 433.02648

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCC(CCC1=CC(=C(C=C1)Cl)C(=O)NCC23CC4CC(C2)CC(C4)C3)O

Isomeric SMILES

CC(C)NC[C@H](CCC1=CC(=C(C=C1)Cl)C(=O)NCC23CC4CC(C2)CC(C4)C3)O

InChI

InChI=1S/C25H37ClN2O2/c1-16(2)27-14-21(29)5-3-17-4-6-23(26)22(10-17)24(30)28-15-25-11-18-7-19(12-25)9-20(8-18)13-25/h4,6,10,16,18-21,27,29H,3,5,7-9,11-15H2,1-2H3,(H,28,30)/t18?,19?,20?,21-,25?/m0/s1