4-methoxy-9-(pyrrol-1-ylmethyl)-9H-xanthene-1-carboxylic acid

Systemtic Name: 4-methoxy-9-(pyrrol-1-ylmethyl)-9H-xanthene-1-carboxylic acid Openeye Name: 4-methoxy-9-(pyrrol-1-ylmethyl)-9H-xanthene-1-carboxylic acid CAS Name: 4-methoxy-9-(1-pyrrolylmethyl)-9H-xanthene-1-carboxylic acid IUPAC Name: 4-methoxy-9-(pyrrol-1-ylmethyl)-9H-xanthene-1-carboxylic acid Traditional Name: 4-methoxy-9-(pyrrol-1-ylmethyl)-9H-xanthene-1-carboxylic acid Formula: C20H17NO4 MolecularWeight: 335.35328

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C=C1)C(=O)O)C(C3=CC=CC=C3O2)CN4C=CC=C4

Isomeric SMILES

COC1=C2C(=C(C=C1)C(=O)O)C(C3=CC=CC=C3O2)CN4C=CC=C4

InChI

InChI=1S/C20H17NO4/c1-24-17-9-8-14(20(22)23)18-15(12-21-10-4-5-11-21)13-6-2-3-7-16(13)25-19(17)18/h2-11,15H,12H2,1H3,(H,22,23)