N-[3-(5-chloranyl-1,3-dihydrobenzotriazol-2-yl)-4-methoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]-2-(3-pentadecylphenoxy)butanamide

Systemtic Name: N-[3-(5-chloranyl-1,3-dihydrobenzotriazol-2-yl)-4-methoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]-2-(3-pentadecylphenoxy)butanamide Openeye Name: N-[3-(5-chloro-1,3-dihydrobenzotriazol-2-yl)-4-methoxy-6-oxo-cyclohexa-2,4-dien-1-ylidene]-2-(3-pentadecylphenoxy)butanamide CAS Name: N-[3-(5-chloro-1,3-dihydrobenzotriazol-2-yl)-4-methoxy-6-oxo-1-cyclohexa-2,4-dienylidene]-2-(3-pentadecylphenoxy)butanamide IUPAC Name: N-[3-(5-chloro-1,3-dihydrobenzotriazol-2-yl)-4-methoxy-6-oxocyclohexa-2,4-dien-1-ylidene]-2-(3-pentadecylphenoxy)butanamide Traditional Name: N-[3-(5-chloro-1,3-dihydrobenzotriazol-2-yl)-6-keto-4-methoxy-cyclohexa-2,4-dien-1-ylidene]-2-(3-pentadecylphenoxy)butyramide Formula: C38H51ClN4O4 MolecularWeight: 663.28894

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC1=CC(=CC=C1)OC(CC)C(=O)N=C2C=C(C(=CC2=O)OC)N3NC4=C(N3)C=C(C=C4)Cl

Isomeric SMILES

CCCCCCCCCCCCCCCC1=CC(=CC=C1)OC(CC)C(=O)N=C2C=C(C(=CC2=O)OC)N3NC4=C(N3)C=C(C=C4)Cl

InChI

InChI=1S/C38H51ClN4O4/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-19-28-20-18-21-30(24-28)47-36(5-2)38(45)40-33-26-34(37(46-3)27-35(33)44)43-41-31-23-22-29(39)25-32(31)42-43/h18,20-27,36,41-42H,4-17,19H2,1-3H3