4-[3-(1H-isoquinolin-2-yl)propoxy]-2-nitro-aniline

Systemtic Name: 4-[3-(1H-isoquinolin-2-yl)propoxy]-2-nitro-aniline Openeye Name: 4-[3-(1H-isoquinolin-2-yl)propoxy]-2-nitro-aniline CAS Name: 4-[3-(1H-isoquinolin-2-yl)propoxy]-2-nitroaniline IUPAC Name: 4-[3-(1H-isoquinolin-2-yl)propoxy]-2-nitroaniline Traditional Name: [4-[3-(1H-isoquinolin-2-yl)propoxy]-2-nitro-phenyl]amine Formula: C18H19N3O3 MolecularWeight: 325.36176

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C=CN1CCCOC3=CC(=C(C=C3)N)[N+](=O)[O-]

Isomeric SMILES

C1C2=CC=CC=C2C=CN1CCCOC3=CC(=C(C=C3)N)[N+](=O)[O-]

InChI

InChI=1S/C18H19N3O3/c19-17-7-6-16(12-18(17)21(22)23)24-11-3-9-20-10-8-14-4-1-2-5-15(14)13-20/h1-2,4-8,10,12H,3,9,11,13,19H2