methyl 3-[3-(4-azanyl-3-methyl-phenyl)-4-(2,3-dihydro-1H-inden-2-yloxy)-5-nitro-phenyl]propanoate

Systemtic Name: methyl 3-[3-(4-azanyl-3-methyl-phenyl)-4-(2,3-dihydro-1H-inden-2-yloxy)-5-nitro-phenyl]propanoate Openeye Name: methyl 3-[3-(4-amino-3-methyl-phenyl)-4-indan-2-yloxy-5-nitro-phenyl]propanoate CAS Name: 3-[3-(4-amino-3-methylphenyl)-4-(2,3-dihydro-1H-inden-2-yloxy)-5-nitrophenyl]propanoic acid methyl ester IUPAC Name: methyl 3-[3-(4-amino-3-methylphenyl)-4-(2,3-dihydro-1H-inden-2-yloxy)-5-nitrophenyl]propanoate Traditional Name: 3-[3-(4-amino-3-methyl-phenyl)-4-indan-2-yloxy-5-nitro-phenyl]propionic acid methyl ester Formula: C26H26N2O5 MolecularWeight: 446.49504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=CC(=CC(=C2OC3CC4=CC=CC=C4C3)[N+](=O)[O-])CCC(=O)OC)N

Isomeric SMILES

CC1=C(C=CC(=C1)C2=CC(=CC(=C2OC3CC4=CC=CC=C4C3)[N+](=O)[O-])CCC(=O)OC)N

InChI

InChI=1S/C26H26N2O5/c1-16-11-20(8-9-23(16)27)22-12-17(7-10-25(29)32-2)13-24(28(30)31)26(22)33-21-14-18-5-3-4-6-19(18)15-21/h3-6,8-9,11-13,21H,7,10,14-15,27H2,1-2H3