2-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-1-oxidanyl-1-phenyl-2,3,6,7,8,9,10,10a-octahydropyrido[1,2-a]azepin-4-one

Systemtic Name: 2-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-1-oxidanyl-1-phenyl-2,3,6,7,8,9,10,10a-octahydropyrido[1,2-a]azepin-4-one Openeye Name: 2-[2-(azepan-1-yl)-2-oxo-ethyl]-1-hydroxy-1-phenyl-2,3,6,7,8,9,10,10a-octahydropyrido[1,2-a]azepin-4-one CAS Name: 2-[2-(1-azepanyl)-2-oxoethyl]-1-hydroxy-1-phenyl-2,3,6,7,8,9,10,10a-octahydropyrido[1,2-a]azepin-4-one IUPAC Name: 2-[2-(azepan-1-yl)-2-oxoethyl]-1-hydroxy-1-phenyl-2,3,6,7,8,9,10,10a-octahydropyrido[1,2-a]azepin-4-one Traditional Name: 2-[2-(azepan-1-yl)-2-keto-ethyl]-1-hydroxy-1-phenyl-2,3,6,7,8,9,10,10a-octahydropyrid[1,2-a]azepin-4-one Formula: C24H34N2O3 MolecularWeight: 398.53836

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CC2CC(=O)N3CCCCCC3C2(C4=CC=CC=C4)O

Isomeric SMILES

C1CCCN(CC1)C(=O)CC2CC(=O)N3CCCCCC3C2(C4=CC=CC=C4)O

InChI

InChI=1S/C24H34N2O3/c27-22(25-14-8-1-2-9-15-25)17-20-18-23(28)26-16-10-4-7-13-21(26)24(20,29)19-11-5-3-6-12-19/h3,5-6,11-12,20-21,29H,1-2,4,7-10,13-18H2