(3-ethoxycarbonyl-5-methoxy-1-benzofuran-2-yl)methyl-propan-2-yl-azanium

Systemtic Name: (3-ethoxycarbonyl-5-methoxy-1-benzofuran-2-yl)methyl-propan-2-yl-azanium Openeye Name: (3-ethoxycarbonyl-5-methoxy-benzofuran-2-yl)methyl-isopropyl-ammonium CAS Name: (3-ethoxycarbonyl-5-methoxy-2-benzofuranyl)methyl-propan-2-ylammonium IUPAC Name: (3-ethoxycarbonyl-5-methoxy-1-benzofuran-2-yl)methyl-propan-2-ylazanium Traditional Name: (3-carbethoxy-5-methoxy-benzofuran-2-yl)methyl-isopropyl-ammonium Formula: C16H22NO4+ MolecularWeight: 292.35018

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C1C=C(C=C2)OC)C[NH2+]C(C)C

Isomeric SMILES

CCOC(=O)C1=C(OC2=C1C=C(C=C2)OC)C[NH2+]C(C)C

InChI

InChI=1S/C16H21NO4/c1-5-20-16(18)15-12-8-11(19-4)6-7-13(12)21-14(15)9-17-10(2)3/h6-8,10,17H,5,9H2,1-4H3/p+1