N-[4-[4-(9H-xanthen-9-ylcarbonyl)piperazin-1-yl]phenyl]dodecanamide

Systemtic Name: N-[4-[4-(9H-xanthen-9-ylcarbonyl)piperazin-1-yl]phenyl]dodecanamide Openeye Name: N-[4-[4-(9H-xanthene-9-carbonyl)piperazin-1-yl]phenyl]dodecanamide CAS Name: N-[4-[4-[oxo(9H-xanthen-9-yl)methyl]-1-piperazinyl]phenyl]dodecanamide IUPAC Name: N-[4-[4-(9H-xanthene-9-carbonyl)piperazin-1-yl]phenyl]dodecanamide Traditional Name: N-[4-[4-(9H-xanthene-9-carbonyl)piperazino]phenyl]lauramide Formula: C36H45N3O3 MolecularWeight: 567.7608

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)NC1=CC=C(C=C1)N2CCN(CC2)C(=O)C3C4=CC=CC=C4OC5=CC=CC=C35

Isomeric SMILES

CCCCCCCCCCCC(=O)NC1=CC=C(C=C1)N2CCN(CC2)C(=O)C3C4=CC=CC=C4OC5=CC=CC=C35

InChI

InChI=1S/C36H45N3O3/c1-2-3-4-5-6-7-8-9-10-19-34(40)37-28-20-22-29(23-21-28)38-24-26-39(27-25-38)36(41)35-30-15-11-13-17-32(30)42-33-18-14-12-16-31(33)35/h11-18,20-23,35H,2-10,19,24-27H2,1H3,(H,37,40)