(2S)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-N-(methylcarbamoyl)propanamide

Systemtic Name: (2S)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-N-(methylcarbamoyl)propanamide Openeye Name: (2S)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-N-(methylcarbamoyl)propanamide CAS Name: (2S)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-N-(methylcarbamoyl)propanamide IUPAC Name: (2S)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-N-(methylcarbamoyl)propanamide Traditional Name: (2S)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-N-(methylcarbamoyl)propionamide Formula: C14H19N3O4 MolecularWeight: 293.31836

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC)NC1=CC2=C(C=C1)OCCCO2

Isomeric SMILES

C[C@@H](C(=O)NC(=O)NC)NC1=CC2=C(C=C1)OCCCO2

InChI

InChI=1S/C14H19N3O4/c1-9(13(18)17-14(19)15-2)16-10-4-5-11-12(8-10)21-7-3-6-20-11/h4-5,8-9,16H,3,6-7H2,1-2H3,(H2,15,17,18,19)/t9-/m0/s1