4-azanyl-3-chloranyl-2-hept-4-yn-2-yloxy-N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)benzamide

Systemtic Name: 4-azanyl-3-chloranyl-2-hept-4-yn-2-yloxy-N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)benzamide Openeye Name: 4-amino-3-chloro-N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-2-(1-methylhex-3-ynoxy)benzamide CAS Name: 4-amino-3-chloro-2-hept-4-yn-2-yloxy-N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)benzamide IUPAC Name: 4-amino-3-chloro-2-hept-4-yn-2-yloxy-N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)benzamide Traditional Name: 4-amino-3-chloro-N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-2-(1-methylhex-3-ynoxy)benzamide Formula: C22H30ClN3O2 MolecularWeight: 403.9455

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Descriptors Computed from Structure

Canonical SMILES:

CCC#CCC(C)OC1=C(C=CC(=C1Cl)N)C(=O)NC2CC3CCC(C2)N3C

Isomeric SMILES

CCC#CCC(C)OC1=C(C=CC(=C1Cl)N)C(=O)NC2CC3CCC(C2)N3C

InChI

InChI=1S/C22H30ClN3O2/c1-4-5-6-7-14(2)28-21-18(10-11-19(24)20(21)23)22(27)25-15-12-16-8-9-17(13-15)26(16)3/h10-11,14-17H,4,7-9,12-13,24H2,1-3H3,(H,25,27)