2-methoxyethyl 1-[3-[(2-chloranyl-4-nitro-phenyl)amino]propyl]-2-methyl-5-oxidanyl-benzo[g]indole-3-carboxylate

Systemtic Name: 2-methoxyethyl 1-[3-[(2-chloranyl-4-nitro-phenyl)amino]propyl]-2-methyl-5-oxidanyl-benzo[g]indole-3-carboxylate Openeye Name: 2-methoxyethyl 1-[3-(2-chloro-4-nitro-anilino)propyl]-5-hydroxy-2-methyl-benzo[g]indole-3-carboxylate CAS Name: 1-[3-(2-chloro-4-nitroanilino)propyl]-5-hydroxy-2-methyl-3-benzo[g]indolecarboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 1-[3-(2-chloro-4-nitroanilino)propyl]-5-hydroxy-2-methylbenzo[g]indole-3-carboxylate Traditional Name: 1-[3-(2-chloro-4-nitro-anilino)propyl]-5-hydroxy-2-methyl-benz[g]indole-3-carboxylic acid 2-methoxyethyl ester Formula: C26H26ClN3O6 MolecularWeight: 511.95414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1CCCNC3=C(C=C(C=C3)[N+](=O)[O-])Cl)C4=CC=CC=C4C(=C2)O)C(=O)OCCOC

Isomeric SMILES

CC1=C(C2=C(N1CCCNC3=C(C=C(C=C3)[N+](=O)[O-])Cl)C4=CC=CC=C4C(=C2)O)C(=O)OCCOC

InChI

InChI=1S/C26H26ClN3O6/c1-16-24(26(32)36-13-12-35-2)20-15-23(31)18-6-3-4-7-19(18)25(20)29(16)11-5-10-28-22-9-8-17(30(33)34)14-21(22)27/h3-4,6-9,14-15,28,31H,5,10-13H2,1-2H3