6-chloranyl-2,4-dimethyl-3-oxidanylidene-N-(1-phenethylpiperidin-4-yl)-1,4-benzoxazine-8-carboxamide hydrate hydrochloride

Systemtic Name: 6-chloranyl-2,4-dimethyl-3-oxidanylidene-N-(1-phenethylpiperidin-4-yl)-1,4-benzoxazine-8-carboxamide hydrate hydrochloride Openeye Name: 6-chloro-2,4-dimethyl-3-oxo-N-(1-phenethyl-4-piperidyl)-1,4-benzoxazine-8-carboxamide hydrate hydrochloride CAS Name: 6-chloro-2,4-dimethyl-3-oxo-N-(1-phenethyl-4-piperidinyl)-1,4-benzoxazine-8-carboxamide hydrate hydrochloride IUPAC Name: 6-chloro-2,4-dimethyl-3-oxo-N-(1-phenethylpiperidin-4-yl)-1,4-benzoxazine-8-carboxamide hydrate hydrochloride Traditional Name: 6-chloro-3-keto-2,4-dimethyl-N-(1-phenethyl-4-piperidyl)-1,4-benzoxazine-8-carboxamide hydrate hydrochloride Formula: C24H31Cl2N3O4 MolecularWeight: 496.42664

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C2=C(O1)C(=CC(=C2)Cl)C(=O)NC3CCN(CC3)CCC4=CC=CC=C4)C.O.Cl

Isomeric SMILES

CC1C(=O)N(C2=C(O1)C(=CC(=C2)Cl)C(=O)NC3CCN(CC3)CCC4=CC=CC=C4)C.O.Cl

InChI

InChI=1S/C24H28ClN3O3.ClH.H2O/c1-16-24(30)27(2)21-15-18(25)14-20(22(21)31-16)23(29)26-19-9-12-28(13-10-19)11-8-17-6-4-3-5-7-17;;/h3-7,14-16,19H,8-13H2,1-2H3,(H,26,29);1H;1H2