N-[3-(1,3-benzodioxol-5-ylamino)-3-oxidanylidene-propyl]-4,7-dimethoxy-1H-indole-2-carboxamide

Systemtic Name: N-[3-(1,3-benzodioxol-5-ylamino)-3-oxidanylidene-propyl]-4,7-dimethoxy-1H-indole-2-carboxamide Openeye Name: N-[3-(1,3-benzodioxol-5-ylamino)-3-oxo-propyl]-4,7-dimethoxy-1H-indole-2-carboxamide CAS Name: N-[3-(1,3-benzodioxol-5-ylamino)-3-oxopropyl]-4,7-dimethoxy-1H-indole-2-carboxamide IUPAC Name: N-[3-(1,3-benzodioxol-5-ylamino)-3-oxopropyl]-4,7-dimethoxy-1H-indole-2-carboxamide Traditional Name: N-[3-(1,3-benzodioxol-5-ylamino)-3-keto-propyl]-4,7-dimethoxy-1H-indole-2-carboxamide Formula: C21H21N3O6 MolecularWeight: 411.40794

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C=C(NC2=C(C=C1)OC)C(=O)NCCC(=O)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

COC1=C2C=C(NC2=C(C=C1)OC)C(=O)NCCC(=O)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H21N3O6/c1-27-15-5-6-17(28-2)20-13(15)10-14(24-20)21(26)22-8-7-19(25)23-12-3-4-16-18(9-12)30-11-29-16/h3-6,9-10,24H,7-8,11H2,1-2H3,(H,22,26)(H,23,25)