2-methoxy-5-[(6,7,8,9-tetrahydro-5H-carbazol-3-ylcarbonylamino)methyl]benzoic acid

Systemtic Name: 2-methoxy-5-[(6,7,8,9-tetrahydro-5H-carbazol-3-ylcarbonylamino)methyl]benzoic acid Openeye Name: 2-methoxy-5-[(6,7,8,9-tetrahydro-5H-carbazole-3-carbonylamino)methyl]benzoic acid CAS Name: 2-methoxy-5-[[[oxo(6,7,8,9-tetrahydro-5H-carbazol-3-yl)methyl]amino]methyl]benzoic acid IUPAC Name: 2-methoxy-5-[(6,7,8,9-tetrahydro-5H-carbazole-3-carbonylamino)methyl]benzoic acid Traditional Name: 2-methoxy-5-[(6,7,8,9-tetrahydro-5H-carbazole-3-carbonylamino)methyl]benzoic acid Formula: C22H22N2O4 MolecularWeight: 378.42108

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)C2=CC3=C(C=C2)NC4=C3CCCC4)C(=O)O

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)C2=CC3=C(C=C2)NC4=C3CCCC4)C(=O)O

InChI

InChI=1S/C22H22N2O4/c1-28-20-9-6-13(10-17(20)22(26)27)12-23-21(25)14-7-8-19-16(11-14)15-4-2-3-5-18(15)24-19/h6-11,24H,2-5,12H2,1H3,(H,23,25)(H,26,27)