4-chloranyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-[(9-ethylcarbazol-3-yl)methyl]-3-nitro-benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-[(9-ethylcarbazol-3-yl)methyl]-3-nitro-benzenesulfonamide Openeye Name: 4-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-[(9-ethylcarbazol-3-yl)methyl]-3-nitro-benzenesulfonamide CAS Name: 4-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-[(9-ethyl-3-carbazolyl)methyl]-3-nitrobenzenesulfonamide IUPAC Name: 4-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-[(9-ethylcarbazol-3-yl)methyl]-3-nitrobenzenesulfonamide Traditional Name: 4-chloro-N-[(9-ethylcarbazol-3-yl)methyl]-N-homoveratryl-3-nitro-benzenesulfonamide Formula: C31H30ClN3O6S MolecularWeight: 608.1044

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)CN(CCC3=CC(=C(C=C3)OC)OC)S(=O)(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-])C5=CC=CC=C51

Isomeric SMILES

CCN1C2=C(C=C(C=C2)CN(CCC3=CC(=C(C=C3)OC)OC)S(=O)(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-])C5=CC=CC=C51

InChI

InChI=1S/C31H30ClN3O6S/c1-4-34-27-8-6-5-7-24(27)25-17-22(9-13-28(25)34)20-33(16-15-21-10-14-30(40-2)31(18-21)41-3)42(38,39)23-11-12-26(32)29(19-23)35(36)37/h5-14,17-19H,4,15-16,20H2,1-3H3