butyl 6-(4-chloranylbutanoylamino)phenazine-1-carboxylate

Systemtic Name: butyl 6-(4-chloranylbutanoylamino)phenazine-1-carboxylate Openeye Name: butyl 6-(4-chlorobutanoylamino)phenazine-1-carboxylate CAS Name: 6-[(4-chloro-1-oxobutyl)amino]-1-phenazinecarboxylic acid butyl ester IUPAC Name: butyl 6-(4-chlorobutanoylamino)phenazine-1-carboxylate Traditional Name: 6-(4-chlorobutanoylamino)phenazine-1-carboxylic acid butyl ester Formula: C21H22ClN3O3 MolecularWeight: 399.87068

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=C2C(=CC=C1)N=C3C(=N2)C=CC=C3NC(=O)CCCCl

Isomeric SMILES

CCCCOC(=O)C1=C2C(=CC=C1)N=C3C(=N2)C=CC=C3NC(=O)CCCCl

InChI

InChI=1S/C21H22ClN3O3/c1-2-3-13-28-21(27)14-7-4-8-15-19(14)24-17-10-5-9-16(20(17)25-15)23-18(26)11-6-12-22/h4-5,7-10H,2-3,6,11-13H2,1H3,(H,23,26)