N-[(3-ethynylphenyl)carbamoyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[(3-ethynylphenyl)carbamoyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[(3-ethynylphenyl)carbamoyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[(3-ethynylanilino)-oxomethyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[(3-ethynylphenyl)carbamoyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[(3-ethynylphenyl)carbamoyl]-piperonylamide Formula: C17H12N2O4 MolecularWeight: 308.28818

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=CC=C1)NC(=O)NC(=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

C#CC1=CC(=CC=C1)NC(=O)NC(=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C17H12N2O4/c1-2-11-4-3-5-13(8-11)18-17(21)19-16(20)12-6-7-14-15(9-12)23-10-22-14/h1,3-9H,10H2,(H2,18,19,20,21)