1-[(4-methoxyphenyl)methyl]-3-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)urea

Systemtic Name: 1-[(4-methoxyphenyl)methyl]-3-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)urea Openeye Name: 1-[(4-methoxyphenyl)methyl]-3-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)urea CAS Name: 1-[(4-methoxyphenyl)methyl]-3-[2-(1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]urea IUPAC Name: 1-[(4-methoxyphenyl)methyl]-3-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)urea Traditional Name: 1-p-anisyl-3-(2-propionyl-3,4-dihydro-1H-isoquinolin-7-yl)urea Formula: C21H25N3O3 MolecularWeight: 367.4415

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)NCC3=CC=C(C=C3)OC

Isomeric SMILES

CCC(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)NCC3=CC=C(C=C3)OC

InChI

InChI=1S/C21H25N3O3/c1-3-20(25)24-11-10-16-6-7-18(12-17(16)14-24)23-21(26)22-13-15-4-8-19(27-2)9-5-15/h4-9,12H,3,10-11,13-14H2,1-2H3,(H2,22,23,26)