1-ethyl-2-[(2-nitrophenyl)methylsulfonyl]-1,3,4,9-tetrahydropyrido[3,4-b]indole

Systemtic Name: 1-ethyl-2-[(2-nitrophenyl)methylsulfonyl]-1,3,4,9-tetrahydropyrido[3,4-b]indole Openeye Name: 1-ethyl-2-[(2-nitrophenyl)methylsulfonyl]-1,3,4,9-tetrahydropyrido[3,4-b]indole CAS Name: 1-ethyl-2-[(2-nitrophenyl)methylsulfonyl]-1,3,4,9-tetrahydropyrido[3,4-b]indole IUPAC Name: 1-ethyl-2-[(2-nitrophenyl)methylsulfonyl]-1,3,4,9-tetrahydropyrido[3,4-b]indole Traditional Name: 1-ethyl-2-(2-nitrobenzyl)sulfonyl-1,3,4,9-tetrahydro-$b-carboline Formula: C20H21N3O4S MolecularWeight: 399.46344

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C2=C(CCN1S(=O)(=O)CC3=CC=CC=C3[N+](=O)[O-])C4=CC=CC=C4N2

Isomeric SMILES

CCC1C2=C(CCN1S(=O)(=O)CC3=CC=CC=C3[N+](=O)[O-])C4=CC=CC=C4N2

InChI

InChI=1S/C20H21N3O4S/c1-2-18-20-16(15-8-4-5-9-17(15)21-20)11-12-22(18)28(26,27)13-14-7-3-6-10-19(14)23(24)25/h3-10,18,21H,2,11-13H2,1H3