(3R)-1-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-2-oxidanylidene-ethyl]piperidine-3-carboxamide

Systemtic Name: (3R)-1-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-2-oxidanylidene-ethyl]piperidine-3-carboxamide Openeye Name: (3R)-1-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-2-oxo-ethyl]piperidine-3-carboxamide CAS Name: (3R)-1-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-2-oxoethyl]-3-piperidinecarboxamide IUPAC Name: (3R)-1-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-2-oxoethyl]piperidine-3-carboxamide Traditional Name: (3R)-1-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-2-keto-ethyl]nipecotamide Formula: C17H23N3O4 MolecularWeight: 333.38222

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC(=O)NC2=CC3=C(C=C2)OCCCO3)C(=O)N

Isomeric SMILES

C1C[C@H](CN(C1)CC(=O)NC2=CC3=C(C=C2)OCCCO3)C(=O)N

InChI

InChI=1S/C17H23N3O4/c18-17(22)12-3-1-6-20(10-12)11-16(21)19-13-4-5-14-15(9-13)24-8-2-7-23-14/h4-5,9,12H,1-3,6-8,10-11H2,(H2,18,22)(H,19,21)/t12-/m1/s1