4-[[[1-(2-morpholin-4-yl-2-oxidanylidene-ethyl)indol-3-yl]methylideneamino]methyl]benzoic acid

Systemtic Name: 4-[[[1-(2-morpholin-4-yl-2-oxidanylidene-ethyl)indol-3-yl]methylideneamino]methyl]benzoic acid Openeye Name: 4-[[[1-(2-morpholino-2-oxo-ethyl)indol-3-yl]methyleneamino]methyl]benzoic acid CAS Name: 4-[[[1-[2-(4-morpholinyl)-2-oxoethyl]-3-indolyl]methylideneamino]methyl]benzoic acid IUPAC Name: 4-[[[1-(2-morpholin-4-yl-2-oxoethyl)indol-3-yl]methylideneamino]methyl]benzoic acid Traditional Name: 4-[[[1-(2-keto-2-morpholino-ethyl)indol-3-yl]methyleneamino]methyl]benzoic acid Formula: C23H23N3O4 MolecularWeight: 405.44642

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)CN2C=C(C3=CC=CC=C32)C=NCC4=CC=C(C=C4)C(=O)O

Isomeric SMILES

C1COCCN1C(=O)CN2C=C(C3=CC=CC=C32)C=NCC4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C23H23N3O4/c27-22(25-9-11-30-12-10-25)16-26-15-19(20-3-1-2-4-21(20)26)14-24-13-17-5-7-18(8-6-17)23(28)29/h1-8,14-15H,9-13,16H2,(H,28,29)