1-[6-chloranyl-1-ethenyl-2-(4-nitrophenyl)sulfonyl-3,4-dihydro-1H-pyrido[3,4-b]indol-9-yl]prop-2-en-1-one

Systemtic Name: 1-[6-chloranyl-1-ethenyl-2-(4-nitrophenyl)sulfonyl-3,4-dihydro-1H-pyrido[3,4-b]indol-9-yl]prop-2-en-1-one Openeye Name: 1-[6-chloro-2-(4-nitrophenyl)sulfonyl-1-vinyl-3,4-dihydro-1H-pyrido[3,4-b]indol-9-yl]prop-2-en-1-one CAS Name: 1-[6-chloro-1-ethenyl-2-(4-nitrophenyl)sulfonyl-3,4-dihydro-1H-pyrido[3,4-b]indol-9-yl]-2-propen-1-one IUPAC Name: 1-[6-chloro-1-ethenyl-2-(4-nitrophenyl)sulfonyl-3,4-dihydro-1H-pyrido[3,4-b]indol-9-yl]prop-2-en-1-one Traditional Name: 1-(6-chloro-2-nosyl-1-vinyl-3,4-dihydro-1H-$b-carbolin-9-yl)prop-2-en-1-one Formula: C22H18ClN3O5S MolecularWeight: 471.91342

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Descriptors Computed from Structure

Canonical SMILES:

C=CC1C2=C(CCN1S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])C4=C(N2C(=O)C=C)C=CC(=C4)Cl

Isomeric SMILES

C=CC1C2=C(CCN1S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])C4=C(N2C(=O)C=C)C=CC(=C4)Cl

InChI

InChI=1S/C22H18ClN3O5S/c1-3-19-22-17(18-13-14(23)5-10-20(18)25(22)21(27)4-2)11-12-24(19)32(30,31)16-8-6-15(7-9-16)26(28)29/h3-10,13,19H,1-2,11-12H2