3-[4-(aminomethyl)phenyl]-N-(2-azanylethyl)-1-chloranyl-N-propyl-naphthalene-2-sulfonamide dihydrochloride

Systemtic Name: 3-[4-(aminomethyl)phenyl]-N-(2-azanylethyl)-1-chloranyl-N-propyl-naphthalene-2-sulfonamide dihydrochloride Openeye Name: N-(2-aminoethyl)-3-[4-(aminomethyl)phenyl]-1-chloro-N-propyl-naphthalene-2-sulfonamide dihydrochloride CAS Name: N-(2-aminoethyl)-3-[4-(aminomethyl)phenyl]-1-chloro-N-propyl-2-naphthalenesulfonamide dihydrochloride IUPAC Name: N-(2-aminoethyl)-3-[4-(aminomethyl)phenyl]-1-chloro-N-propylnaphthalene-2-sulfonamide dihydrochloride Traditional Name: N-(2-aminoethyl)-3-[4-(aminomethyl)phenyl]-1-chloro-N-propyl-naphthalene-2-sulfonamide dihydrochloride Formula: C22H28Cl3N3O2S MolecularWeight: 504.90062

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCN)S(=O)(=O)C1=C(C2=CC=CC=C2C=C1C3=CC=C(C=C3)CN)Cl.Cl.Cl

Isomeric SMILES

CCCN(CCN)S(=O)(=O)C1=C(C2=CC=CC=C2C=C1C3=CC=C(C=C3)CN)Cl.Cl.Cl

InChI

InChI=1S/C22H26ClN3O2S.2ClH/c1-2-12-26(13-11-24)29(27,28)22-20(17-9-7-16(15-25)8-10-17)14-18-5-3-4-6-19(18)21(22)23;;/h3-10,14H,2,11-13,15,24-25H2,1H3;2*1H