N-[(3S,4S,7R)-1-(3-azanyl-3-oxidanylidene-propyl)-7-methyl-3-oxidanyl-azepan-4-yl]-3-cyclohexyl-propanamide

Systemtic Name: N-[(3S,4S,7R)-1-(3-azanyl-3-oxidanylidene-propyl)-7-methyl-3-oxidanyl-azepan-4-yl]-3-cyclohexyl-propanamide Openeye Name: N-[(3S,4S,7R)-1-(3-amino-3-oxo-propyl)-3-hydroxy-7-methyl-azepan-4-yl]-3-cyclohexyl-propanamide CAS Name: N-[(3S,4S,7R)-1-(3-amino-3-oxopropyl)-3-hydroxy-7-methyl-4-azepanyl]-3-cyclohexylpropanamide IUPAC Name: N-[(3S,4S,7R)-1-(3-amino-3-oxopropyl)-3-hydroxy-7-methylazepan-4-yl]-3-cyclohexylpropanamide Traditional Name: N-[(3S,4S,7R)-1-(3-amino-3-keto-propyl)-3-hydroxy-7-methyl-azepan-4-yl]-3-cyclohexyl-propionamide Formula: C19H35N3O3 MolecularWeight: 353.4995

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(CN1CCC(=O)N)O)NC(=O)CCC2CCCCC2

Isomeric SMILES

C[C@@H]1CC[C@@H]([C@H](CN1CCC(=O)N)O)NC(=O)CCC2CCCCC2

InChI

InChI=1S/C19H35N3O3/c1-14-7-9-16(17(23)13-22(14)12-11-18(20)24)21-19(25)10-8-15-5-3-2-4-6-15/h14-17,23H,2-13H2,1H3,(H2,20,24)(H,21,25)/t14-,16+,17+/m1/s1