5-[(E)-(5-methoxy-2-oxidanylidene-1H-indol-3-ylidene)methyl]-2-methyl-4-(3-pyrrolidin-1-ylpropyl)-1H-pyrrole-3-carboxylic acid

Systemtic Name: 5-[(E)-(5-methoxy-2-oxidanylidene-1H-indol-3-ylidene)methyl]-2-methyl-4-(3-pyrrolidin-1-ylpropyl)-1H-pyrrole-3-carboxylic acid Openeye Name: 5-[(E)-(5-methoxy-2-oxo-indolin-3-ylidene)methyl]-2-methyl-4-(3-pyrrolidin-1-ylpropyl)-1H-pyrrole-3-carboxylic acid CAS Name: 5-[(E)-(5-methoxy-2-oxo-1H-indol-3-ylidene)methyl]-2-methyl-4-[3-(1-pyrrolidinyl)propyl]-1H-pyrrole-3-carboxylic acid IUPAC Name: 5-[(E)-(5-methoxy-2-oxo-1H-indol-3-ylidene)methyl]-2-methyl-4-(3-pyrrolidin-1-ylpropyl)-1H-pyrrole-3-carboxylic acid Traditional Name: 5-[(E)-(2-keto-5-methoxy-indolin-3-ylidene)methyl]-2-methyl-4-(3-pyrrolidinopropyl)-1H-pyrrole-3-carboxylic acid Formula: C23H27N3O4 MolecularWeight: 409.47818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1)C=C2C3=C(C=CC(=C3)OC)NC2=O)CCCN4CCCC4)C(=O)O

Isomeric SMILES

CC1=C(C(=C(N1)/C=C/2\C3=C(C=CC(=C3)OC)NC2=O)CCCN4CCCC4)C(=O)O

InChI

InChI=1S/C23H27N3O4/c1-14-21(23(28)29)16(6-5-11-26-9-3-4-10-26)20(24-14)13-18-17-12-15(30-2)7-8-19(17)25-22(18)27/h7-8,12-13,24H,3-6,9-11H2,1-2H3,(H,25,27)(H,28,29)/b18-13+