6-chloranyl-3-oxidanylidene-N-[1-(phenylmethyl)piperidin-4-yl]-4H-1,4-benzoxazine-8-carboxamide

Systemtic Name: 6-chloranyl-3-oxidanylidene-N-[1-(phenylmethyl)piperidin-4-yl]-4H-1,4-benzoxazine-8-carboxamide Openeye Name: N-(1-benzyl-4-piperidyl)-6-chloro-3-oxo-4H-1,4-benzoxazine-8-carboxamide CAS Name: 6-chloro-3-oxo-N-[1-(phenylmethyl)-4-piperidinyl]-4H-1,4-benzoxazine-8-carboxamide IUPAC Name: N-(1-benzylpiperidin-4-yl)-6-chloro-3-oxo-4H-1,4-benzoxazine-8-carboxamide Traditional Name: N-(1-benzyl-4-piperidyl)-6-chloro-3-keto-4H-1,4-benzoxazine-8-carboxamide Formula: C21H22ClN3O3 MolecularWeight: 399.87068

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)C2=CC(=CC3=C2OCC(=O)N3)Cl)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1NC(=O)C2=CC(=CC3=C2OCC(=O)N3)Cl)CC4=CC=CC=C4

InChI

InChI=1S/C21H22ClN3O3/c22-15-10-17(20-18(11-15)24-19(26)13-28-20)21(27)23-16-6-8-25(9-7-16)12-14-4-2-1-3-5-14/h1-5,10-11,16H,6-9,12-13H2,(H,23,27)(H,24,26)