N-[1-oxidanylidene-1-(propylamino)propan-2-yl]-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide

Systemtic Name: N-[1-oxidanylidene-1-(propylamino)propan-2-yl]-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide Openeye Name: N-[1-methyl-2-oxo-2-(propylamino)ethyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide CAS Name: N-[1-oxo-1-(propylamino)propan-2-yl]-3,4-dihydro-2H-1,5-benzodioxepin-7-carboxamide IUPAC Name: N-[1-oxo-1-(propylamino)propan-2-yl]-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide Traditional Name: N-[2-keto-1-methyl-2-(propylamino)ethyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-carboxamide Formula: C16H22N2O4 MolecularWeight: 306.35688

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)NC(=O)C1=CC2=C(C=C1)OCCCO2

Isomeric SMILES

CCCNC(=O)C(C)NC(=O)C1=CC2=C(C=C1)OCCCO2

InChI

InChI=1S/C16H22N2O4/c1-3-7-17-15(19)11(2)18-16(20)12-5-6-13-14(10-12)22-9-4-8-21-13/h5-6,10-11H,3-4,7-9H2,1-2H3,(H,17,19)(H,18,20)