ethyl 1-[(4-ethanoyl-2,3-dihydro-1,4-benzoxazin-6-yl)sulfonyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[(4-ethanoyl-2,3-dihydro-1,4-benzoxazin-6-yl)sulfonyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[(4-acetyl-2,3-dihydro-1,4-benzoxazin-6-yl)sulfonyl]piperidine-3-carboxylate CAS Name: 1-[(4-acetyl-2,3-dihydro-1,4-benzoxazin-6-yl)sulfonyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(4-acetyl-2,3-dihydro-1,4-benzoxazin-6-yl)sulfonyl]piperidine-3-carboxylate Traditional Name: 1-[(4-acetyl-2,3-dihydro-1,4-benzoxazin-6-yl)sulfonyl]nipecotic acid ethyl ester Formula: C18H24N2O6S MolecularWeight: 396.45796

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)S(=O)(=O)C2=CC3=C(C=C2)OCCN3C(=O)C

Isomeric SMILES

CCOC(=O)C1CCCN(C1)S(=O)(=O)C2=CC3=C(C=C2)OCCN3C(=O)C

InChI

InChI=1S/C18H24N2O6S/c1-3-25-18(22)14-5-4-8-19(12-14)27(23,24)15-6-7-17-16(11-15)20(13(2)21)9-10-26-17/h6-7,11,14H,3-5,8-10,12H2,1-2H3