methyl 3-pyren-1-yl-1H-indole-2-carboxylate

Systemtic Name: methyl 3-pyren-1-yl-1H-indole-2-carboxylate Openeye Name: methyl 3-pyren-1-yl-1H-indole-2-carboxylate CAS Name: 3-(1-pyrenyl)-1H-indole-2-carboxylic acid methyl ester IUPAC Name: methyl 3-pyren-1-yl-1H-indole-2-carboxylate Traditional Name: 3-pyren-1-yl-1H-indole-2-carboxylic acid methyl ester Formula: C26H17NO2 MolecularWeight: 375.41868

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=CC=CC=C2N1)C3=C4C=CC5=CC=CC6=C5C4=C(C=C6)C=C3

Isomeric SMILES

COC(=O)C1=C(C2=CC=CC=C2N1)C3=C4C=CC5=CC=CC6=C5C4=C(C=C6)C=C3

InChI

InChI=1S/C26H17NO2/c1-29-26(28)25-24(20-7-2-3-8-21(20)27-25)19-14-12-17-10-9-15-5-4-6-16-11-13-18(19)23(17)22(15)16/h2-14,27H,1H3