4-[2-[4-[(4-aminophenyl)-methyl-amino]butylamino]-1-oxidanyl-ethyl]-2-methylsulfonyl-phenol

Systemtic Name: 4-[2-[4-[(4-aminophenyl)-methyl-amino]butylamino]-1-oxidanyl-ethyl]-2-methylsulfonyl-phenol Openeye Name: 4-[2-[4-(4-amino-N-methyl-anilino)butylamino]-1-hydroxy-ethyl]-2-methylsulfonyl-phenol CAS Name: 4-[2-[4-(4-amino-N-methylanilino)butylamino]-1-hydroxyethyl]-2-methylsulfonylphenol IUPAC Name: 4-[2-[4-(4-amino-N-methylanilino)butylamino]-1-hydroxyethyl]-2-methylsulfonylphenol Traditional Name: 4-[2-[4-(4-amino-N-methyl-anilino)butylamino]-1-hydroxy-ethyl]-2-mesyl-phenol Formula: C20H29N3O4S MolecularWeight: 407.52696

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCCNCC(C1=CC(=C(C=C1)O)S(=O)(=O)C)O)C2=CC=C(C=C2)N

Isomeric SMILES

CN(CCCCNCC(C1=CC(=C(C=C1)O)S(=O)(=O)C)O)C2=CC=C(C=C2)N

InChI

InChI=1S/C20H29N3O4S/c1-23(17-8-6-16(21)7-9-17)12-4-3-11-22-14-19(25)15-5-10-18(24)20(13-15)28(2,26)27/h5-10,13,19,22,24-25H,3-4,11-12,14,21H2,1-2H3