methyl 2-(N'-propan-2-ylcarbamimidoyl)benzo[e][1]benzofuran-5-carboxylate hydrochloride

Systemtic Name: methyl 2-(N'-propan-2-ylcarbamimidoyl)benzo[e][1]benzofuran-5-carboxylate hydrochloride Openeye Name: methyl 2-(N'-isopropylcarbamimidoyl)benzo[e]benzofuran-5-carboxylate hydrochloride CAS Name: 2-[amino(propan-2-ylimino)methyl]-5-benzo[e]benzofurancarboxylic acid methyl ester hydrochloride IUPAC Name: methyl 2-(N'-propan-2-ylcarbamimidoyl)benzo[e][1]benzofuran-5-carboxylate hydrochloride Traditional Name: 2-(N'-isopropylamidino)benzo[e]benzofuran-5-carboxylic acid methyl ester hydrochloride Formula: C18H19ClN2O3 MolecularWeight: 346.80806

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N=C(C1=CC2=C(O1)C=C(C3=CC=CC=C32)C(=O)OC)N.Cl

Isomeric SMILES

CC(C)N=C(C1=CC2=C(O1)C=C(C3=CC=CC=C32)C(=O)OC)N.Cl

InChI

InChI=1S/C18H18N2O3.ClH/c1-10(2)20-17(19)16-8-13-11-6-4-5-7-12(11)14(18(21)22-3)9-15(13)23-16;/h4-10H,1-3H3,(H2,19,20);1H