N-[4-(aminomethyl)phenyl]-1-chloranyl-N-[1-(methylamino)pentan-2-yl]naphthalene-2-sulfonamide

Systemtic Name: N-[4-(aminomethyl)phenyl]-1-chloranyl-N-[1-(methylamino)pentan-2-yl]naphthalene-2-sulfonamide Openeye Name: N-[4-(aminomethyl)phenyl]-1-chloro-N-[1-(methylaminomethyl)butyl]naphthalene-2-sulfonamide CAS Name: N-[4-(aminomethyl)phenyl]-1-chloro-N-[1-(methylamino)pentan-2-yl]-2-naphthalenesulfonamide IUPAC Name: N-[4-(aminomethyl)phenyl]-1-chloro-N-[1-(methylamino)pentan-2-yl]naphthalene-2-sulfonamide Traditional Name: N-[4-(aminomethyl)phenyl]-1-chloro-N-[1-(methylaminomethyl)butyl]naphthalene-2-sulfonamide Formula: C23H28ClN3O2S MolecularWeight: 446.00532

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CNC)N(C1=CC=C(C=C1)CN)S(=O)(=O)C2=C(C3=CC=CC=C3C=C2)Cl

Isomeric SMILES

CCCC(CNC)N(C1=CC=C(C=C1)CN)S(=O)(=O)C2=C(C3=CC=CC=C3C=C2)Cl

InChI

InChI=1S/C23H28ClN3O2S/c1-3-6-20(16-26-2)27(19-12-9-17(15-25)10-13-19)30(28,29)22-14-11-18-7-4-5-8-21(18)23(22)24/h4-5,7-14,20,26H,3,6,15-16,25H2,1-2H3