carbamimidoyl 3-ethyl-5-(phenylmethyl)-1-benzofuran-2-carboxylate hydrochloride

Systemtic Name: carbamimidoyl 3-ethyl-5-(phenylmethyl)-1-benzofuran-2-carboxylate hydrochloride Openeye Name: carbamimidoyl 5-benzyl-3-ethyl-benzofuran-2-carboxylate hydrochloride CAS Name: 3-ethyl-5-(phenylmethyl)-2-benzofurancarboxylic acid carbamimidoyl ester hydrochloride IUPAC Name: carbamimidoyl 5-benzyl-3-ethyl-1-benzofuran-2-carboxylate hydrochloride Traditional Name: 5-benzyl-3-ethyl-coumarilic acid amidino ester hydrochloride Formula: C19H19ClN2O3 MolecularWeight: 358.81876

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(OC2=C1C=C(C=C2)CC3=CC=CC=C3)C(=O)OC(=N)N.Cl

Isomeric SMILES

CCC1=C(OC2=C1C=C(C=C2)CC3=CC=CC=C3)C(=O)OC(=N)N.Cl

InChI

InChI=1S/C19H18N2O3.ClH/c1-2-14-15-11-13(10-12-6-4-3-5-7-12)8-9-16(15)23-17(14)18(22)24-19(20)21;/h3-9,11H,2,10H2,1H3,(H3,20,21);1H