N-[4-(2-azanylethylcarbamoyl)-2-methyl-phenyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[4-(2-azanylethylcarbamoyl)-2-methyl-phenyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[4-(2-aminoethylcarbamoyl)-2-methyl-phenyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[4-[(2-aminoethylamino)-oxomethyl]-2-methylphenyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[4-(2-aminoethylcarbamoyl)-2-methylphenyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[4-(2-aminoethylcarbamoyl)-2-methyl-phenyl]-piperonylamide Formula: C18H19N3O4 MolecularWeight: 341.36116

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19N3O4/c1-11-8-12(17(22)20-7-6-19)2-4-14(11)21-18(23)13-3-5-15-16(9-13)25-10-24-15/h2-5,8-9H,6-7,10,19H2,1H3,(H,20,22)(H,21,23)