1-(2-ethanoyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(3-phenylpropyl)urea

Systemtic Name: 1-(2-ethanoyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(3-phenylpropyl)urea Openeye Name: 1-(2-acetyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(3-phenylpropyl)urea CAS Name: 1-(2-acetyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(3-phenylpropyl)urea IUPAC Name: 1-(2-acetyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(3-phenylpropyl)urea Traditional Name: 1-(2-acetyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(3-phenylpropyl)urea Formula: C21H25N3O2 MolecularWeight: 351.4421

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)NCCCC3=CC=CC=C3

Isomeric SMILES

CC(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)NCCCC3=CC=CC=C3

InChI

InChI=1S/C21H25N3O2/c1-16(25)24-13-11-18-9-10-20(14-19(18)15-24)23-21(26)22-12-5-8-17-6-3-2-4-7-17/h2-4,6-7,9-10,14H,5,8,11-13,15H2,1H3,(H2,22,23,26)