N-(5-chloranyl-2-piperidin-1-yl-phenyl)-4-ethanoyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: N-(5-chloranyl-2-piperidin-1-yl-phenyl)-4-ethanoyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: 4-acetyl-N-[5-chloro-2-(1-piperidyl)phenyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: 4-acetyl-N-[5-chloro-2-(1-piperidinyl)phenyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: 4-acetyl-N-(5-chloro-2-piperidin-1-ylphenyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: 4-acetyl-N-(5-chloro-2-piperidino-phenyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C22H24ClN3O3 MolecularWeight: 413.89726

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC(OC2=CC=CC=C21)C(=O)NC3=C(C=CC(=C3)Cl)N4CCCCC4

Isomeric SMILES

CC(=O)N1CC(OC2=CC=CC=C21)C(=O)NC3=C(C=CC(=C3)Cl)N4CCCCC4

InChI

InChI=1S/C22H24ClN3O3/c1-15(27)26-14-21(29-20-8-4-3-7-19(20)26)22(28)24-17-13-16(23)9-10-18(17)25-11-5-2-6-12-25/h3-4,7-10,13,21H,2,5-6,11-12,14H2,1H3,(H,24,28)