1-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]-3-(3,4,5-trimethoxyphenyl)urea

Systemtic Name: 1-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]-3-(3,4,5-trimethoxyphenyl)urea Openeye Name: 1-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]-3-(3,4,5-trimethoxyphenyl)urea CAS Name: 1-[2-(2-methyl-1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]-3-(3,4,5-trimethoxyphenyl)urea IUPAC Name: 1-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]-3-(3,4,5-trimethoxyphenyl)urea Traditional Name: 1-(2-isobutyryl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(3,4,5-trimethoxyphenyl)urea Formula: C23H29N3O5 MolecularWeight: 427.49346

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H29N3O5/c1-14(2)22(27)26-9-8-15-6-7-17(10-16(15)13-26)24-23(28)25-18-11-19(29-3)21(31-5)20(12-18)30-4/h6-7,10-12,14H,8-9,13H2,1-5H3,(H2,24,25,28)