dimethyl 5-[5-[(butan-2-ylamino)methyl]furan-2-yl]benzene-1,3-dicarboxylate hydrochloride

Systemtic Name: dimethyl 5-[5-[(butan-2-ylamino)methyl]furan-2-yl]benzene-1,3-dicarboxylate hydrochloride Openeye Name: dimethyl 5-[5-[(sec-butylamino)methyl]-2-furyl]benzene-1,3-dicarboxylate hydrochloride CAS Name: 5-[5-[(butan-2-ylamino)methyl]-2-furanyl]benzene-1,3-dicarboxylic acid dimethyl ester hydrochloride IUPAC Name: dimethyl 5-[5-[(butan-2-ylamino)methyl]furan-2-yl]benzene-1,3-dicarboxylate hydrochloride Traditional Name: 5-[5-[(sec-butylamino)methyl]-2-furyl]benzene-1,3-dicarboxylic acid dimethyl ester hydrochloride Formula: C19H24ClNO5 MolecularWeight: 381.85056

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NCC1=CC=C(O1)C2=CC(=CC(=C2)C(=O)OC)C(=O)OC.Cl

Isomeric SMILES

CCC(C)NCC1=CC=C(O1)C2=CC(=CC(=C2)C(=O)OC)C(=O)OC.Cl

InChI

InChI=1S/C19H23NO5.ClH/c1-5-12(2)20-11-16-6-7-17(25-16)13-8-14(18(21)23-3)10-15(9-13)19(22)24-4;/h6-10,12,20H,5,11H2,1-4H3;1H