ethyl 4-[2-[4-[(E)-4-ethoxy-4-oxidanylidene-but-2-en-2-yl]phenyl]ethyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-[4-[(E)-4-ethoxy-4-oxidanylidene-but-2-en-2-yl]phenyl]ethyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-[4-[(E)-3-ethoxy-1-methyl-3-oxo-prop-1-enyl]phenyl]ethyl]piperazine-1-carboxylate CAS Name: 4-[2-[4-[(E)-4-ethoxy-4-oxobut-2-en-2-yl]phenyl]ethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[4-[(E)-4-ethoxy-4-oxobut-2-en-2-yl]phenyl]ethyl]piperazine-1-carboxylate Traditional Name: 4-[2-[4-[(E)-3-ethoxy-3-keto-1-methyl-prop-1-enyl]phenyl]ethyl]piperazine-1-carboxylic acid ethyl ester Formula: C21H30N2O4 MolecularWeight: 374.4739

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=C(C)C1=CC=C(C=C1)CCN2CCN(CC2)C(=O)OCC

Isomeric SMILES

CCOC(=O)/C=C(\C)/C1=CC=C(C=C1)CCN2CCN(CC2)C(=O)OCC

InChI

InChI=1S/C21H30N2O4/c1-4-26-20(24)16-17(3)19-8-6-18(7-9-19)10-11-22-12-14-23(15-13-22)21(25)27-5-2/h6-9,16H,4-5,10-15H2,1-3H3/b17-16+