6-chloranyl-4-methylsulfonyl-N-[1-(4-piperidin-1-ylphenyl)ethyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: 6-chloranyl-4-methylsulfonyl-N-[1-(4-piperidin-1-ylphenyl)ethyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: 6-chloro-4-methylsulfonyl-N-[1-[4-(1-piperidyl)phenyl]ethyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: 6-chloro-4-methylsulfonyl-N-[1-[4-(1-piperidinyl)phenyl]ethyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: 6-chloro-4-methylsulfonyl-N-[1-(4-piperidin-1-ylphenyl)ethyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: 6-chloro-4-mesyl-N-[1-(4-piperidinophenyl)ethyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C23H28ClN3O4S MolecularWeight: 478.00412

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)N2CCCCC2)NC(=O)C3CN(C4=C(O3)C=CC(=C4)Cl)S(=O)(=O)C

Isomeric SMILES

CC(C1=CC=C(C=C1)N2CCCCC2)NC(=O)C3CN(C4=C(O3)C=CC(=C4)Cl)S(=O)(=O)C

InChI

InChI=1S/C23H28ClN3O4S/c1-16(17-6-9-19(10-7-17)26-12-4-3-5-13-26)25-23(28)22-15-27(32(2,29)30)20-14-18(24)8-11-21(20)31-22/h6-11,14,16,22H,3-5,12-13,15H2,1-2H3,(H,25,28)