2-diethylaminoethyl 4-[[2-(furan-2-yl)quinolin-4-yl]carbonylamino]benzoate hydrochloride

Systemtic Name: 2-diethylaminoethyl 4-[[2-(furan-2-yl)quinolin-4-yl]carbonylamino]benzoate hydrochloride Openeye Name: 2-diethylaminoethyl 4-[[2-(2-furyl)quinoline-4-carbonyl]amino]benzoate hydrochloride CAS Name: 4-[[[2-(2-furanyl)-4-quinolinyl]-oxomethyl]amino]benzoic acid 2-diethylaminoethyl ester hydrochloride IUPAC Name: 2-diethylaminoethyl 4-[[2-(furan-2-yl)quinoline-4-carbonyl]amino]benzoate hydrochloride Traditional Name: 4-[[2-(2-furyl)quinoline-4-carbonyl]amino]benzoic acid 2-diethylaminoethyl ester hydrochloride Formula: C27H28ClN3O4 MolecularWeight: 493.98192

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CO4.Cl

Isomeric SMILES

CCN(CC)CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CO4.Cl

InChI

InChI=1S/C27H27N3O4.ClH/c1-3-30(4-2)15-17-34-27(32)19-11-13-20(14-12-19)28-26(31)22-18-24(25-10-7-16-33-25)29-23-9-6-5-8-21(22)23;/h5-14,16,18H,3-4,15,17H2,1-2H3,(H,28,31);1H