3-ethyl-2-methyl-7-oxidanyl-8-[[(phenylmethyl)amino]methyl]chromen-4-one hydrochloride

Systemtic Name: 3-ethyl-2-methyl-7-oxidanyl-8-[[(phenylmethyl)amino]methyl]chromen-4-one hydrochloride Openeye Name: 8-[(benzylamino)methyl]-3-ethyl-7-hydroxy-2-methyl-chromen-4-one hydrochloride CAS Name: 3-ethyl-7-hydroxy-2-methyl-8-[[(phenylmethyl)amino]methyl]-1-benzopyran-4-one hydrochloride IUPAC Name: 8-[(benzylamino)methyl]-3-ethyl-7-hydroxy-2-methylchromen-4-one hydrochloride Traditional Name: 8-[(benzylamino)methyl]-3-ethyl-7-hydroxy-2-methyl-chromone hydrochloride Formula: C20H22ClNO3 MolecularWeight: 359.84658

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(OC2=C(C1=O)C=CC(=C2CNCC3=CC=CC=C3)O)C.Cl

Isomeric SMILES

CCC1=C(OC2=C(C1=O)C=CC(=C2CNCC3=CC=CC=C3)O)C.Cl

InChI

InChI=1S/C20H21NO3.ClH/c1-3-15-13(2)24-20-16(19(15)23)9-10-18(22)17(20)12-21-11-14-7-5-4-6-8-14;/h4-10,21-22H,3,11-12H2,1-2H3;1H