N-[2-[3-[3-(aminomethyl)phenyl]propylamino]ethyl]-1-chloranyl-naphthalene-2-sulfonamide

Systemtic Name: N-[2-[3-[3-(aminomethyl)phenyl]propylamino]ethyl]-1-chloranyl-naphthalene-2-sulfonamide Openeye Name: N-[2-[3-[3-(aminomethyl)phenyl]propylamino]ethyl]-1-chloro-naphthalene-2-sulfonamide CAS Name: N-[2-[3-[3-(aminomethyl)phenyl]propylamino]ethyl]-1-chloro-2-naphthalenesulfonamide IUPAC Name: N-[2-[3-[3-(aminomethyl)phenyl]propylamino]ethyl]-1-chloronaphthalene-2-sulfonamide Traditional Name: N-[2-[3-[3-(aminomethyl)phenyl]propylamino]ethyl]-1-chloro-naphthalene-2-sulfonamide Formula: C22H26ClN3O2S MolecularWeight: 431.97874

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=C2Cl)S(=O)(=O)NCCNCCCC3=CC(=CC=C3)CN

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=C2Cl)S(=O)(=O)NCCNCCCC3=CC(=CC=C3)CN

InChI

InChI=1S/C22H26ClN3O2S/c23-22-20-9-2-1-8-19(20)10-11-21(22)29(27,28)26-14-13-25-12-4-7-17-5-3-6-18(15-17)16-24/h1-3,5-6,8-11,15,25-26H,4,7,12-14,16,24H2