4-[(3-chloranyl-1-adamantyl)carbonyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: 4-[(3-chloranyl-1-adamantyl)carbonyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: 4-(3-chloroadamantane-1-carbonyl)-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: 4-[(3-chloro-1-adamantyl)-oxomethyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: 4-(3-chloroadamantane-1-carbonyl)-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: 4-(3-chloroadamantane-1-carbonyl)-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C21H25ClN2O3 MolecularWeight: 388.8878

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1CN(C2=CC=CC=C2O1)C(=O)C34CC5CC(C3)CC(C5)(C4)Cl

Isomeric SMILES

CNC(=O)C1CN(C2=CC=CC=C2O1)C(=O)C34CC5CC(C3)CC(C5)(C4)Cl

InChI

InChI=1S/C21H25ClN2O3/c1-23-18(25)17-11-24(15-4-2-3-5-16(15)27-17)19(26)20-7-13-6-14(8-20)10-21(22,9-13)12-20/h2-5,13-14,17H,6-12H2,1H3,(H,23,25)