ethyl 4-[5-[(butan-2-ylamino)methyl]furan-2-yl]benzoate hydrochloride

Systemtic Name: ethyl 4-[5-[(butan-2-ylamino)methyl]furan-2-yl]benzoate hydrochloride Openeye Name: ethyl 4-[5-[(sec-butylamino)methyl]-2-furyl]benzoate hydrochloride CAS Name: 4-[5-[(butan-2-ylamino)methyl]-2-furanyl]benzoic acid ethyl ester hydrochloride IUPAC Name: ethyl 4-[5-[(butan-2-ylamino)methyl]furan-2-yl]benzoate hydrochloride Traditional Name: 4-[5-[(sec-butylamino)methyl]-2-furyl]benzoic acid ethyl ester hydrochloride Formula: C18H24ClNO3 MolecularWeight: 337.84106

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23NO3.ClH/c1-4-13(3)19-12-16-10-11-17(22-16)14-6-8-15(9-7-14)18(20)21-5-2;/h6-11,13,19H,4-5,12H2,1-3H3;1H