methyl 2-azanyl-5-oxidanyl-4-(phenylmethyl)benzo[g][1]benzofuran-3-carboxylate

Systemtic Name: methyl 2-azanyl-5-oxidanyl-4-(phenylmethyl)benzo[g][1]benzofuran-3-carboxylate Openeye Name: methyl 2-amino-4-benzyl-5-hydroxy-benzo[g]benzofuran-3-carboxylate CAS Name: 2-amino-5-hydroxy-4-(phenylmethyl)-3-benzo[g]benzofurancarboxylic acid methyl ester IUPAC Name: methyl 2-amino-4-benzyl-5-hydroxybenzo[g][1]benzofuran-3-carboxylate Traditional Name: 2-amino-4-benzyl-5-hydroxy-benzo[g]benzofuran-3-carboxylic acid methyl ester Formula: C21H17NO4 MolecularWeight: 347.36398

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(OC2=C1C(=C(C3=CC=CC=C32)O)CC4=CC=CC=C4)N

Isomeric SMILES

COC(=O)C1=C(OC2=C1C(=C(C3=CC=CC=C32)O)CC4=CC=CC=C4)N

InChI

InChI=1S/C21H17NO4/c1-25-21(24)17-16-15(11-12-7-3-2-4-8-12)18(23)13-9-5-6-10-14(13)19(16)26-20(17)22/h2-10,23H,11,22H2,1H3