N-[(Z)-3-(azepan-1-yl)-1-(1,3-benzodioxol-5-yl)-3-oxidanylidene-prop-1-en-2-yl]furan-2-carboxamide

Systemtic Name: N-[(Z)-3-(azepan-1-yl)-1-(1,3-benzodioxol-5-yl)-3-oxidanylidene-prop-1-en-2-yl]furan-2-carboxamide Openeye Name: N-[(Z)-1-(azepane-1-carbonyl)-2-(1,3-benzodioxol-5-yl)vinyl]furan-2-carboxamide CAS Name: N-[(Z)-3-(1-azepanyl)-1-(1,3-benzodioxol-5-yl)-3-oxoprop-1-en-2-yl]-2-furancarboxamide IUPAC Name: N-[(Z)-3-(azepan-1-yl)-1-(1,3-benzodioxol-5-yl)-3-oxoprop-1-en-2-yl]furan-2-carboxamide Traditional Name: N-[(Z)-1-(azepane-1-carbonyl)-2-(1,3-benzodioxol-5-yl)vinyl]-2-furamide Formula: C21H22N2O5 MolecularWeight: 382.40978

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C(=CC2=CC3=C(C=C2)OCO3)NC(=O)C4=CC=CO4

Isomeric SMILES

C1CCCN(CC1)C(=O)/C(=C/C2=CC3=C(C=C2)OCO3)/NC(=O)C4=CC=CO4

InChI

InChI=1S/C21H22N2O5/c24-20(18-6-5-11-26-18)22-16(21(25)23-9-3-1-2-4-10-23)12-15-7-8-17-19(13-15)28-14-27-17/h5-8,11-13H,1-4,9-10,14H2,(H,22,24)/b16-12-