3-(4-phenylpiperazin-1-yl)propyl 9H-xanthene-9-carboxylate

Systemtic Name: 3-(4-phenylpiperazin-1-yl)propyl 9H-xanthene-9-carboxylate Openeye Name: 3-(4-phenylpiperazin-1-yl)propyl 9H-xanthene-9-carboxylate CAS Name: 9H-xanthene-9-carboxylic acid 3-(4-phenyl-1-piperazinyl)propyl ester IUPAC Name: 3-(4-phenylpiperazin-1-yl)propyl 9H-xanthene-9-carboxylate Traditional Name: 9H-xanthene-9-carboxylic acid 3-(4-phenylpiperazino)propyl ester Formula: C27H28N2O3 MolecularWeight: 428.52282

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H28N2O3/c30-27(26-22-11-4-6-13-24(22)32-25-14-7-5-12-23(25)26)31-20-8-15-28-16-18-29(19-17-28)21-9-2-1-3-10-21/h1-7,9-14,26H,8,15-20H2