2-[4-(diethylamino)but-2-ynyl]-2-(phenylmethyl)indene-1,3-dione hydrochloride

Systemtic Name: 2-[4-(diethylamino)but-2-ynyl]-2-(phenylmethyl)indene-1,3-dione hydrochloride Openeye Name: 2-benzyl-2-[4-(diethylamino)but-2-ynyl]indane-1,3-dione hydrochloride CAS Name: 2-[4-(diethylamino)but-2-ynyl]-2-(phenylmethyl)indene-1,3-dione hydrochloride IUPAC Name: 2-benzyl-2-[4-(diethylamino)but-2-ynyl]indene-1,3-dione hydrochloride Traditional Name: 2-benzyl-2-[4-(diethylamino)but-2-ynyl]indane-1,3-quinone hydrochloride Formula: C24H26ClNO2 MolecularWeight: 395.92174

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC#CCC1(C(=O)C2=CC=CC=C2C1=O)CC3=CC=CC=C3.Cl

Isomeric SMILES

CCN(CC)CC#CCC1(C(=O)C2=CC=CC=C2C1=O)CC3=CC=CC=C3.Cl

InChI

InChI=1S/C24H25NO2.ClH/c1-3-25(4-2)17-11-10-16-24(18-19-12-6-5-7-13-19)22(26)20-14-8-9-15-21(20)23(24)27;/h5-9,12-15H,3-4,16-18H2,1-2H3;1H