1-[3-[[4-methyl-7-oxidanyl-2-oxidanylidene-3-(phenylmethyl)chromen-8-yl]methylamino]propyl]pyrrolidin-2-one hydrochloride

Systemtic Name: 1-[3-[[4-methyl-7-oxidanyl-2-oxidanylidene-3-(phenylmethyl)chromen-8-yl]methylamino]propyl]pyrrolidin-2-one hydrochloride Openeye Name: 1-[3-[(3-benzyl-7-hydroxy-4-methyl-2-oxo-chromen-8-yl)methylamino]propyl]pyrrolidin-2-one hydrochloride CAS Name: 1-[3-[[7-hydroxy-4-methyl-2-oxo-3-(phenylmethyl)-1-benzopyran-8-yl]methylamino]propyl]-2-pyrrolidinone hydrochloride IUPAC Name: 1-[3-[(3-benzyl-7-hydroxy-4-methyl-2-oxochromen-8-yl)methylamino]propyl]pyrrolidin-2-one hydrochloride Traditional Name: 1-[3-[(3-benzyl-7-hydroxy-2-keto-4-methyl-chromen-8-yl)methylamino]propyl]-2-pyrrolidone hydrochloride Formula: C25H29ClN2O4 MolecularWeight: 456.96176

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2CNCCCN3CCCC3=O)O)CC4=CC=CC=C4.Cl

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2CNCCCN3CCCC3=O)O)CC4=CC=CC=C4.Cl

InChI

InChI=1S/C25H28N2O4.ClH/c1-17-19-10-11-22(28)21(16-26-12-6-14-27-13-5-9-23(27)29)24(19)31-25(30)20(17)15-18-7-3-2-4-8-18;/h2-4,7-8,10-11,26,28H,5-6,9,12-16H2,1H3;1H