5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-1-prop-2-ynyl-pyrrole-3-carboxamide

Systemtic Name: 5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-1-prop-2-ynyl-pyrrole-3-carboxamide Openeye Name: 5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-1-prop-2-ynyl-pyrrole-3-carboxamide CAS Name: 5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-1-prop-2-ynyl-3-pyrrolecarboxamide IUPAC Name: 5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-1-prop-2-ynylpyrrole-3-carboxamide Traditional Name: 5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-1-propargyl-pyrrole-3-carboxamide Formula: C18H18N2O3 MolecularWeight: 310.34712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1CC#C)C2=CC3=C(C=C2)OCCCO3)C(=O)N

Isomeric SMILES

CC1=C(C=C(N1CC#C)C2=CC3=C(C=C2)OCCCO3)C(=O)N

InChI

InChI=1S/C18H18N2O3/c1-3-7-20-12(2)14(18(19)21)11-15(20)13-5-6-16-17(10-13)23-9-4-8-22-16/h1,5-6,10-11H,4,7-9H2,2H3,(H2,19,21)