ethyl 2-methyl-6-(3-nitrophenyl)-5-oxidanyl-1-prop-2-enyl-indole-3-carboxylate

Systemtic Name: ethyl 2-methyl-6-(3-nitrophenyl)-5-oxidanyl-1-prop-2-enyl-indole-3-carboxylate Openeye Name: ethyl 1-allyl-5-hydroxy-2-methyl-6-(3-nitrophenyl)indole-3-carboxylate CAS Name: 5-hydroxy-2-methyl-6-(3-nitrophenyl)-1-prop-2-enyl-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-hydroxy-2-methyl-6-(3-nitrophenyl)-1-prop-2-enylindole-3-carboxylate Traditional Name: 1-allyl-5-hydroxy-2-methyl-6-(3-nitrophenyl)indole-3-carboxylic acid ethyl ester Formula: C21H20N2O5 MolecularWeight: 380.3939

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=CC(=C(C=C21)O)C3=CC(=CC=C3)[N+](=O)[O-])CC=C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=CC(=C(C=C21)O)C3=CC(=CC=C3)[N+](=O)[O-])CC=C)C

InChI

InChI=1S/C21H20N2O5/c1-4-9-22-13(3)20(21(25)28-5-2)17-12-19(24)16(11-18(17)22)14-7-6-8-15(10-14)23(26)27/h4,6-8,10-12,24H,1,5,9H2,2-3H3