3-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]propyl 9H-xanthene-9-carboxylate

Systemtic Name: 3-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]propyl 9H-xanthene-9-carboxylate Openeye Name: 3-[4-[(E)-cinnamyl]piperazin-1-yl]propyl 9H-xanthene-9-carboxylate CAS Name: 9H-xanthene-9-carboxylic acid 3-[4-[(E)-3-phenylprop-2-enyl]-1-piperazinyl]propyl ester IUPAC Name: 3-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]propyl 9H-xanthene-9-carboxylate Traditional Name: 9H-xanthene-9-carboxylic acid 3-[4-[(E)-cinnamyl]piperazino]propyl ester Formula: C30H32N2O3 MolecularWeight: 468.58668

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCOC(=O)C2C3=CC=CC=C3OC4=CC=CC=C24)CC=CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CCCOC(=O)C2C3=CC=CC=C3OC4=CC=CC=C24)C/C=C/C5=CC=CC=C5

InChI

InChI=1S/C30H32N2O3/c33-30(29-25-13-4-6-15-27(25)35-28-16-7-5-14-26(28)29)34-23-9-18-32-21-19-31(20-22-32)17-8-12-24-10-2-1-3-11-24/h1-8,10-16,29H,9,17-23H2/b12-8+