4-(5-chloranyl-3-phenyl-indazol-1-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]butanamide

Systemtic Name: 4-(5-chloranyl-3-phenyl-indazol-1-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]butanamide Openeye Name: 4-(5-chloro-3-phenyl-indazol-1-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]butanamide CAS Name: 4-(5-chloro-3-phenyl-1-indazolyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]butanamide IUPAC Name: 4-(5-chloro-3-phenylindazol-1-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]butanamide Traditional Name: 4-(5-chloro-3-phenyl-indazol-1-yl)-N-homoveratryl-butyramide Formula: C27H28ClN3O3 MolecularWeight: 477.98252

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)CCCN2C3=C(C=C(C=C3)Cl)C(=N2)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)CCCN2C3=C(C=C(C=C3)Cl)C(=N2)C4=CC=CC=C4)OC

InChI

InChI=1S/C27H28ClN3O3/c1-33-24-13-10-19(17-25(24)34-2)14-15-29-26(32)9-6-16-31-23-12-11-21(28)18-22(23)27(30-31)20-7-4-3-5-8-20/h3-5,7-8,10-13,17-18H,6,9,14-16H2,1-2H3,(H,29,32)