1-(5-chloranyl-2-methoxy-phenyl)-3-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)urea

Systemtic Name: 1-(5-chloranyl-2-methoxy-phenyl)-3-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)urea Openeye Name: 1-(5-chloro-2-methoxy-phenyl)-3-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)urea CAS Name: 1-(5-chloro-2-methoxyphenyl)-3-[2-(1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]urea IUPAC Name: 1-(5-chloro-2-methoxyphenyl)-3-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)urea Traditional Name: 1-(5-chloro-2-methoxy-phenyl)-3-(2-propionyl-3,4-dihydro-1H-isoquinolin-7-yl)urea Formula: C20H22ClN3O3 MolecularWeight: 387.85998

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)NC3=C(C=CC(=C3)Cl)OC

Isomeric SMILES

CCC(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)NC3=C(C=CC(=C3)Cl)OC

InChI

InChI=1S/C20H22ClN3O3/c1-3-19(25)24-9-8-13-4-6-16(10-14(13)12-24)22-20(26)23-17-11-15(21)5-7-18(17)27-2/h4-7,10-11H,3,8-9,12H2,1-2H3,(H2,22,23,26)