1-(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(3-nitrophenyl)urea

Systemtic Name: 1-(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(3-nitrophenyl)urea Openeye Name: 1-(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(3-nitrophenyl)urea CAS Name: 1-(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(3-nitrophenyl)urea IUPAC Name: 1-(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(3-nitrophenyl)urea Traditional Name: 1-(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(3-nitrophenyl)urea Formula: C17H18N4O3 MolecularWeight: 326.34982

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2=C(C1)C=C(C=C2)NC(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CN1CCC2=C(C1)C=C(C=C2)NC(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H18N4O3/c1-20-8-7-12-5-6-15(9-13(12)11-20)19-17(22)18-14-3-2-4-16(10-14)21(23)24/h2-6,9-10H,7-8,11H2,1H3,(H2,18,19,22)