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1-[(2,6-dimethyl-2,3-dihydro-1,4-benzoxazin-4-yl)carbonyl]piperidine-3-carboxylic acid

1-[(2,6-dimethyl-2,3-dihydro-1,4-benzoxazin-4-yl)carbonyl]piperidine-3-carboxylic acid

Systemtic Name:1-[(2,6-dimethyl-2,3-dihydro-1,4-benzoxazin-4-yl)carbonyl]piperidine-3-carboxylic acid
Openeye Name:1-(2,6-dimethyl-2,3-dihydro-1,4-benzoxazine-4-carbonyl)piperidine-3-carboxylic acid
CAS Name:1-[(2,6-dimethyl-2,3-dihydro-1,4-benzoxazin-4-yl)-oxomethyl]-3-piperidinecarboxylic acid
IUPAC Name:1-(2,6-dimethyl-2,3-dihydro-1,4-benzoxazine-4-carbonyl)piperidine-3-carboxylic acid
Traditional Name:1-(2,6-dimethyl-2,3-dihydro-1,4-benzoxazine-4-carbonyl)nipecotic acid
Formula: C17H22N2O4
MolecularWeight: 318.36758
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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(C2=C(O1)C=CC(=C2)C)C(=O)N3CCCC(C3)C(=O)O


Isomeric SMILES

CC1CN(C2=C(O1)C=CC(=C2)C)C(=O)N3CCCC(C3)C(=O)O


InChI

InChI=1S/C17H22N2O4/c1-11-5-6-15-14(8-11)19(9-12(2)23-15)17(22)18-7-3-4-13(10-18)16(20)21/h5-6,8,12-13H,3-4,7,9-10H2,1-2H3,(H,20,21)


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