methyl 3-[4-(cyclopentylmethoxy)-3-(1-methylindol-5-yl)-5-nitro-phenyl]propanoate

Systemtic Name: methyl 3-[4-(cyclopentylmethoxy)-3-(1-methylindol-5-yl)-5-nitro-phenyl]propanoate Openeye Name: methyl 3-[4-(cyclopentylmethoxy)-3-(1-methylindol-5-yl)-5-nitro-phenyl]propanoate CAS Name: 3-[4-(cyclopentylmethoxy)-3-(1-methyl-5-indolyl)-5-nitrophenyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-(cyclopentylmethoxy)-3-(1-methylindol-5-yl)-5-nitrophenyl]propanoate Traditional Name: 3-[4-(cyclopentylmethoxy)-3-(1-methylindol-5-yl)-5-nitro-phenyl]propionic acid methyl ester Formula: C25H28N2O5 MolecularWeight: 436.50022

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC2=C1C=CC(=C2)C3=CC(=CC(=C3OCC4CCCC4)[N+](=O)[O-])CCC(=O)OC

Isomeric SMILES

CN1C=CC2=C1C=CC(=C2)C3=CC(=CC(=C3OCC4CCCC4)[N+](=O)[O-])CCC(=O)OC

InChI

InChI=1S/C25H28N2O5/c1-26-12-11-20-15-19(8-9-22(20)26)21-13-18(7-10-24(28)31-2)14-23(27(29)30)25(21)32-16-17-5-3-4-6-17/h8-9,11-15,17H,3-7,10,16H2,1-2H3