[(Z)-1-azanyltridecylideneamino] 3-oxidanylidene-2-phenyl-3-[(2,4,6-trimethoxyphenyl)amino]propanoate

Systemtic Name: [(Z)-1-azanyltridecylideneamino] 3-oxidanylidene-2-phenyl-3-[(2,4,6-trimethoxyphenyl)amino]propanoate Openeye Name: [(Z)-1-aminotridecylideneamino] 3-oxo-2-phenyl-3-(2,4,6-trimethoxyanilino)propanoate CAS Name: 3-oxo-2-phenyl-3-(2,4,6-trimethoxyanilino)propanoic acid [(Z)-1-aminotridecylideneamino] ester IUPAC Name: [(Z)-1-aminotridecylideneamino] 3-oxo-2-phenyl-3-(2,4,6-trimethoxyanilino)propanoate Traditional Name: 3-keto-2-phenyl-3-(2,4,6-trimethoxyanilino)propionic acid [(Z)-1-aminotridecylideneamino] ester Formula: C31H45N3O6 MolecularWeight: 555.7055

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(=NOC(=O)C(C1=CC=CC=C1)C(=O)NC2=C(C=C(C=C2OC)OC)OC)N

Isomeric SMILES

CCCCCCCCCCCC/C(=N/OC(=O)C(C1=CC=CC=C1)C(=O)NC2=C(C=C(C=C2OC)OC)OC)/N

InChI

InChI=1S/C31H45N3O6/c1-5-6-7-8-9-10-11-12-13-17-20-27(32)34-40-31(36)28(23-18-15-14-16-19-23)30(35)33-29-25(38-3)21-24(37-2)22-26(29)39-4/h14-16,18-19,21-22,28H,5-13,17,20H2,1-4H3,(H2,32,34)(H,33,35)