N-(anthracen-9-ylmethyl)-N-[4-(4-azanylbutylamino)butyl]-4-methyl-benzenesulfonamide

Systemtic Name: N-(anthracen-9-ylmethyl)-N-[4-(4-azanylbutylamino)butyl]-4-methyl-benzenesulfonamide Openeye Name: N-[4-(4-aminobutylamino)butyl]-N-(9-anthrylmethyl)-4-methyl-benzenesulfonamide CAS Name: N-[4-(4-aminobutylamino)butyl]-N-(9-anthracenylmethyl)-4-methylbenzenesulfonamide IUPAC Name: N-[4-(4-aminobutylamino)butyl]-N-(anthracen-9-ylmethyl)-4-methylbenzenesulfonamide Traditional Name: N-[4-(4-aminobutylamino)butyl]-N-(9-anthrylmethyl)-4-methyl-benzenesulfonamide Formula: C30H37N3O2S MolecularWeight: 503.69868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CCCCNCCCCN)CC2=C3C=CC=CC3=CC4=CC=CC=C42

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CCCCNCCCCN)CC2=C3C=CC=CC3=CC4=CC=CC=C42

InChI

InChI=1S/C30H37N3O2S/c1-24-14-16-27(17-15-24)36(34,35)33(21-9-8-20-32-19-7-6-18-31)23-30-28-12-4-2-10-25(28)22-26-11-3-5-13-29(26)30/h2-5,10-17,22,32H,6-9,18-21,23,31H2,1H3