methyl 5-acetyloxy-8-methoxy-3-(methoxymethyl)-4-(4-methylphenyl)sulfonyl-benzo[e]indole-1-carboxylate

Systemtic Name: methyl 5-acetyloxy-8-methoxy-3-(methoxymethyl)-4-(4-methylphenyl)sulfonyl-benzo[e]indole-1-carboxylate Openeye Name: methyl 5-acetoxy-8-methoxy-3-(methoxymethyl)-4-(p-tolylsulfonyl)benzo[e]indole-1-carboxylate CAS Name: 5-acetyloxy-8-methoxy-3-(methoxymethyl)-4-(4-methylphenyl)sulfonyl-1-benzo[e]indolecarboxylic acid methyl ester IUPAC Name: methyl 5-acetyloxy-8-methoxy-3-(methoxymethyl)-4-(4-methylphenyl)sulfonylbenzo[e]indole-1-carboxylate Traditional Name: 5-acetoxy-8-methoxy-3-(methoxymethyl)-4-tosyl-benz[e]indole-1-carboxylic acid methyl ester Formula: C26H25NO8S MolecularWeight: 511.5436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=C(C3=C(C=C(C=C3)OC)C4=C2N(C=C4C(=O)OC)COC)OC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=C(C3=C(C=C(C=C3)OC)C4=C2N(C=C4C(=O)OC)COC)OC(=O)C

InChI

InChI=1S/C26H25NO8S/c1-15-6-9-18(10-7-15)36(30,31)25-23-22(21(26(29)34-5)13-27(23)14-32-3)20-12-17(33-4)8-11-19(20)24(25)35-16(2)28/h6-13H,14H2,1-5H3