7-azanyl-2,2-dimethyl-4-(2-piperidin-1-ium-1-ylethyl)-1,4-benzoxazin-3-one

Systemtic Name: 7-azanyl-2,2-dimethyl-4-(2-piperidin-1-ium-1-ylethyl)-1,4-benzoxazin-3-one Openeye Name: 7-amino-2,2-dimethyl-4-(2-piperidin-1-ium-1-ylethyl)-1,4-benzoxazin-3-one CAS Name: 7-amino-2,2-dimethyl-4-[2-(1-piperidin-1-iumyl)ethyl]-1,4-benzoxazin-3-one IUPAC Name: 7-amino-2,2-dimethyl-4-(2-piperidin-1-ium-1-ylethyl)-1,4-benzoxazin-3-one Traditional Name: 7-amino-2,2-dimethyl-4-(2-piperidin-1-ium-1-ylethyl)-1,4-benzoxazin-3-one Formula: C17H26N3O2+ MolecularWeight: 304.40724

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)N(C2=C(O1)C=C(C=C2)N)CC[NH+]3CCCCC3)C

Isomeric SMILES

CC1(C(=O)N(C2=C(O1)C=C(C=C2)N)CC[NH+]3CCCCC3)C

InChI

InChI=1S/C17H25N3O2/c1-17(2)16(21)20(11-10-19-8-4-3-5-9-19)14-7-6-13(18)12-15(14)22-17/h6-7,12H,3-5,8-11,18H2,1-2H3/p+1