2-diethylaminoethyl 4-[(1-butyl-2-oxidanyl-4-oxidanylidene-quinolin-3-yl)carbonylamino]benzoate

Systemtic Name: 2-diethylaminoethyl 4-[(1-butyl-2-oxidanyl-4-oxidanylidene-quinolin-3-yl)carbonylamino]benzoate Openeye Name: 2-diethylaminoethyl 4-[(1-butyl-2-hydroxy-4-oxo-quinoline-3-carbonyl)amino]benzoate CAS Name: 4-[[(1-butyl-2-hydroxy-4-oxo-3-quinolinyl)-oxomethyl]amino]benzoic acid 2-diethylaminoethyl ester IUPAC Name: 2-diethylaminoethyl 4-[(1-butyl-2-hydroxy-4-oxoquinoline-3-carbonyl)amino]benzoate Traditional Name: 4-[(1-butyl-2-hydroxy-4-keto-quinoline-3-carbonyl)amino]benzoic acid 2-diethylaminoethyl ester Formula: C27H33N3O5 MolecularWeight: 479.56802

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=CC=CC=C2C(=O)C(=C1O)C(=O)NC3=CC=C(C=C3)C(=O)OCCN(CC)CC

Isomeric SMILES

CCCCN1C2=CC=CC=C2C(=O)C(=C1O)C(=O)NC3=CC=C(C=C3)C(=O)OCCN(CC)CC

InChI

InChI=1S/C27H33N3O5/c1-4-7-16-30-22-11-9-8-10-21(22)24(31)23(26(30)33)25(32)28-20-14-12-19(13-15-20)27(34)35-18-17-29(5-2)6-3/h8-15,33H,4-7,16-18H2,1-3H3,(H,28,32)