N-[(Z)-[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]-2-(2-oxidanylideneazepan-1-yl)ethanamide

Systemtic Name: N-[(Z)-[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]-2-(2-oxidanylideneazepan-1-yl)ethanamide Openeye Name: N-[(Z)-[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]-2-(2-oxoazepan-1-yl)acetamide CAS Name: N-[(Z)-[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-3-pyrrolyl]methylideneamino]-2-(2-oxo-1-azepanyl)acetamide IUPAC Name: N-[(Z)-[1-(1,3-benzodioxol-5-yl)-2,5-dimethylpyrrol-3-yl]methylideneamino]-2-(2-oxoazepan-1-yl)acetamide Traditional Name: N-[(Z)-[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]-2-(2-ketoazepan-1-yl)acetamide Formula: C22H26N4O4 MolecularWeight: 410.46624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC3=C(C=C2)OCO3)C)C=NNC(=O)CN4CCCCCC4=O

Isomeric SMILES

CC1=CC(=C(N1C2=CC3=C(C=C2)OCO3)C)/C=N\NC(=O)CN4CCCCCC4=O

InChI

InChI=1S/C22H26N4O4/c1-15-10-17(12-23-24-21(27)13-25-9-5-3-4-6-22(25)28)16(2)26(15)18-7-8-19-20(11-18)30-14-29-19/h7-8,10-12H,3-6,9,13-14H2,1-2H3,(H,24,27)/b23-12-