methyl 2-methoxy-5-[[(9-oxidanylidene-2,3-dihydro-1H-pyrrolo[2,1-b]quinazolin-6-yl)carbonylamino]methyl]benzoate

Systemtic Name: methyl 2-methoxy-5-[[(9-oxidanylidene-2,3-dihydro-1H-pyrrolo[2,1-b]quinazolin-6-yl)carbonylamino]methyl]benzoate Openeye Name: methyl 2-methoxy-5-[[(9-oxo-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carbonyl)amino]methyl]benzoate CAS Name: 2-methoxy-5-[[[oxo-(9-oxo-2,3-dihydro-1H-pyrrolo[2,1-b]quinazolin-6-yl)methyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 2-methoxy-5-[[(9-oxo-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carbonyl)amino]methyl]benzoate Traditional Name: 5-[[(9-keto-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carbonyl)amino]methyl]-2-methoxy-benzoic acid methyl ester Formula: C22H21N3O5 MolecularWeight: 407.41924

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)C2=CC3=C(C=C2)C(=O)N4CCCC4=N3)C(=O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)C2=CC3=C(C=C2)C(=O)N4CCCC4=N3)C(=O)OC

InChI

InChI=1S/C22H21N3O5/c1-29-18-8-5-13(10-16(18)22(28)30-2)12-23-20(26)14-6-7-15-17(11-14)24-19-4-3-9-25(19)21(15)27/h5-8,10-11H,3-4,9,12H2,1-2H3,(H,23,26)