methyl 2-[4-[[5-[(E)-2-azido-3-methoxy-3-oxidanylidene-prop-1-enyl]-2-butyl-imidazol-1-yl]methyl]phenyl]benzoate

Systemtic Name: methyl 2-[4-[[5-[(E)-2-azido-3-methoxy-3-oxidanylidene-prop-1-enyl]-2-butyl-imidazol-1-yl]methyl]phenyl]benzoate Openeye Name: methyl 2-[4-[[5-[(E)-2-azido-3-methoxy-3-oxo-prop-1-enyl]-2-butyl-imidazol-1-yl]methyl]phenyl]benzoate CAS Name: 2-[4-[[5-[(E)-2-azido-3-methoxy-3-oxoprop-1-enyl]-2-butyl-1-imidazolyl]methyl]phenyl]benzoic acid methyl ester IUPAC Name: methyl 2-[4-[[5-[(E)-2-azido-3-methoxy-3-oxoprop-1-enyl]-2-butylimidazol-1-yl]methyl]phenyl]benzoate Traditional Name: 2-[4-[[5-[(E)-2-azido-3-keto-3-methoxy-prop-1-enyl]-2-butyl-imidazol-1-yl]methyl]phenyl]benzoic acid methyl ester Formula: C26H27N5O4 MolecularWeight: 473.52368

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)OC)C=C(C(=O)OC)N=[N+]=[N-]

Isomeric SMILES

CCCCC1=NC=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)OC)/C=C(\C(=O)OC)/N=[N+]=[N-]

InChI

InChI=1S/C26H27N5O4/c1-4-5-10-24-28-16-20(15-23(29-30-27)26(33)35-3)31(24)17-18-11-13-19(14-12-18)21-8-6-7-9-22(21)25(32)34-2/h6-9,11-16H,4-5,10,17H2,1-3H3/b23-15+