[4-(4-phenylbutanimidoyl)piperazin-1-yl]-(9H-xanthen-9-yl)methanone

Systemtic Name: [4-(4-phenylbutanimidoyl)piperazin-1-yl]-(9H-xanthen-9-yl)methanone Openeye Name: [4-(4-phenylbutanimidoyl)piperazin-1-yl]-(9H-xanthen-9-yl)methanone CAS Name: [4-(1-imino-4-phenylbutyl)-1-piperazinyl]-(9H-xanthen-9-yl)methanone IUPAC Name: [4-(4-phenylbutanimidoyl)piperazin-1-yl]-(9H-xanthen-9-yl)methanone Traditional Name: [4-(4-phenylbutanimidoyl)piperazino]-(9H-xanthen-9-yl)methanone Formula: C28H29N3O2 MolecularWeight: 439.54876

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=N)CCCC2=CC=CC=C2)C(=O)C3C4=CC=CC=C4OC5=CC=CC=C35

Isomeric SMILES

C1CN(CCN1C(=N)CCCC2=CC=CC=C2)C(=O)C3C4=CC=CC=C4OC5=CC=CC=C35

InChI

InChI=1S/C28H29N3O2/c29-26(16-8-11-21-9-2-1-3-10-21)30-17-19-31(20-18-30)28(32)27-22-12-4-6-14-24(22)33-25-15-7-5-13-23(25)27/h1-7,9-10,12-15,27,29H,8,11,16-20H2