(E)-4-ethoxy-4-oxidanylidene-but-2-enoic acid; 4-(3-piperidin-4-ylpropyl)quinoline

Systemtic Name: (E)-4-ethoxy-4-oxidanylidene-but-2-enoic acid; 4-(3-piperidin-4-ylpropyl)quinoline Openeye Name: (E)-4-ethoxy-4-oxo-but-2-enoic acid; 4-[3-(4-piperidyl)propyl]quinoline CAS Name: (E)-4-ethoxy-4-oxo-2-butenoic acid; 4-[3-(4-piperidinyl)propyl]quinoline IUPAC Name: (E)-4-ethoxy-4-oxobut-2-enoic acid; 4-(3-piperidin-4-ylpropyl)quinoline Traditional Name: (E)-4-ethoxy-4-keto-but-2-enoic acid; 4-[3-(4-piperidyl)propyl]quinoline Formula: C23H30N2O4 MolecularWeight: 398.4953

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC(=O)O.C1CNCCC1CCCC2=CC=NC3=CC=CC=C23

Isomeric SMILES

CCOC(=O)/C=C/C(=O)O.C1CNCCC1CCCC2=CC=NC3=CC=CC=C23

InChI

InChI=1S/C17H22N2.C6H8O4/c1-2-7-17-16(6-1)15(10-13-19-17)5-3-4-14-8-11-18-12-9-14;1-2-10-6(9)4-3-5(7)8/h1-2,6-7,10,13-14,18H,3-5,8-9,11-12H2;3-4H,2H2,1H3,(H,7,8)/b;4-3+