N-[4-[4-(2-methylphenyl)piperazin-1-yl]butyl]anthracene-1-carboxamide

Systemtic Name: N-[4-[4-(2-methylphenyl)piperazin-1-yl]butyl]anthracene-1-carboxamide Openeye Name: N-[4-[4-(o-tolyl)piperazin-1-yl]butyl]anthracene-1-carboxamide CAS Name: N-[4-[4-(2-methylphenyl)-1-piperazinyl]butyl]-1-anthracenecarboxamide IUPAC Name: N-[4-[4-(2-methylphenyl)piperazin-1-yl]butyl]anthracene-1-carboxamide Traditional Name: N-[4-[4-(o-tolyl)piperazino]butyl]anthracene-1-carboxamide Formula: C30H33N3O MolecularWeight: 451.60252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CCN(CC2)CCCCNC(=O)C3=CC=CC4=CC5=CC=CC=C5C=C43

Isomeric SMILES

CC1=CC=CC=C1N2CCN(CC2)CCCCNC(=O)C3=CC=CC4=CC5=CC=CC=C5C=C43

InChI

InChI=1S/C30H33N3O/c1-23-9-2-5-14-29(23)33-19-17-32(18-20-33)16-7-6-15-31-30(34)27-13-8-12-26-21-24-10-3-4-11-25(24)22-28(26)27/h2-5,8-14,21-22H,6-7,15-20H2,1H3,(H,31,34)