propan-2-yl 2-cyano-2-[3-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]quinoxalin-2-yl]ethanoate

Systemtic Name: propan-2-yl 2-cyano-2-[3-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]quinoxalin-2-yl]ethanoate Openeye Name: isopropyl 2-[3-[4-[(E)-cinnamyl]piperazin-1-yl]quinoxalin-2-yl]-2-cyano-acetate CAS Name: 2-cyano-2-[3-[4-[(E)-3-phenylprop-2-enyl]-1-piperazinyl]-2-quinoxalinyl]acetic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-cyano-2-[3-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]quinoxalin-2-yl]acetate Traditional Name: 2-[3-[4-[(E)-cinnamyl]piperazino]quinoxalin-2-yl]-2-cyano-acetic acid isopropyl ester Formula: C27H29N5O2 MolecularWeight: 455.55146

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C(C#N)C1=NC2=CC=CC=C2N=C1N3CCN(CC3)CC=CC4=CC=CC=C4

Isomeric SMILES

CC(C)OC(=O)C(C#N)C1=NC2=CC=CC=C2N=C1N3CCN(CC3)C/C=C/C4=CC=CC=C4

InChI

InChI=1S/C27H29N5O2/c1-20(2)34-27(33)22(19-28)25-26(30-24-13-7-6-12-23(24)29-25)32-17-15-31(16-18-32)14-8-11-21-9-4-3-5-10-21/h3-13,20,22H,14-18H2,1-2H3/b11-8+